Aspenhysysoliif v7 3-Ref

Aspen HYSYS
OLI-Electrolytes Interface
Version Number: V7.3 March 2011

Copyright (c) 1981-2011 by Aspen Technology, Inc. All rights reserved. Aspen HYSYS and the aspen leaf logo are trademarks or registered trademarks of Aspen Technology, Inc., Burlington, MA. All other brand and product names are trademarks or registered trademarks of their respective companies. This manual is intended as a guide to using AspenTechs software. This documentation contains AspenTech proprietary and confidential information and may not be disclosed, used, or copied without the prior consent of AspenTech or as set forth in the applicable license agreement. Users are solely responsible for the proper use of the software and the application of the results obtained. Although AspenTech has tested the software and reviewed the documentation, the sole warranty for the software may be found in the applicable license agreement between AspenTech and the user. ASPENTECH MAKES NO WARRANTY OR REPRESENTATION, EITHER EXPRESSED OR IMPLIED, WITH RESPECT TO THIS DOCUMENTATION, ITS QUALITY, PERFORMANCE, MERCHANTABILITY, OR FITNESS FOR A PARTICULAR PURPOSE. Aspen Technology, Inc. 200 Wheeler Road Burlington, MA 01803-5501 USA Phone: (781) 221-6400 Website http://www.aspentech.com
Aspen HYSYS-OLI Interface
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1.1 Introduction................................................................................... 3 1.2 Aqueous Electrolyte Systems ......................................................... 5 1.2.1 Speciation of Aqueous Electrolytes.............................................. 6 1.2.2 High Ionic Strength Systems...................................................... 9 1.2.3 Process Application................................................................. 11 1.3 Gibbs Free Energy ........................................................................ 14 1.4 OLI Thermodynamic Framework .................................................. 17 1.5 Other Physical Phases in Equilibrium ........................................... 19 1.6 Aspen HYSYS-OLI_Electrolyte Property Package ......................... 20 1.6.1 1.6.2 1.6.3 1.6.4 1.6.5 1.6.6 1.6.7 1.6.8 1.6.9 Electrolyte Calculation Techniques ............................................ 21 Electrolyte Components .......................................................... 21 Chemistry Model Generation .................................................... 22 Electrolytes Nomenclature ....................................................... 23 Electrolyte Properties.............................................................. 25 Disabling Solid Components..................................................... 27 Scaling Tendencies ................................................................. 29 Aspen HYSYS Column Operation............................................... 29 Electrolyte Stream Flash.......................................................... 33
1.7 Range of Applicability .................................................................. 35 1.7.1 1.7.2 1.7.3 1.7.4 Aqueous Systems................................................................... 35 Non-Aqueous Liquid................................................................ 35 Gas & Second Liquid Phase...................................................... 36 Multi-Component Systems ....................................................... 36
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1.8 Aspen HYSYS-OLI Interface Component Databases ......................38 1.8.1 1.8.2 1.8.3 1.8.4 Full Database .........................................................................39 Limited Database ....................................................................39 Special Databases ...................................................................39 Private User Databases - OLI Data Service .................................44
1.9 OLI Engine....................................................................................45
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Note: Installing Aspen HYSYS OLI Interface for V7.2

If you are using the OLI Interface with Aspen HYSYS V7.2, you must download and install the interface from the following URL: http://www.olisystems.com/new-alliances.shtml
1.1 Introduction
Many industrial processes are affected by many production and environmental concerns when dealing with electrolytes. A process cannot be designed and optimized effectively without comprehensively and accurately addressing electrolyte chemistry and phenomena. Electrolyte chemistry is particularly complex and challenging to understand and predict, especially for real industrial systems which contain many components and operate over broad ranges of temperatures, pressures, and concentrations. Many industrial operations need to be aware of the concerns of electrolyte chemistry in these processes and can include: Aqueous chemical and separations processes. Chemical conversion. Solution crystallization. Pharmaceutical and speciality chemical manufacturing. Reactive separations including acid gas treatment. Waste water treatment. Environmental behaviour of wastes, discharges, and accidental releases. Corrosion and scaling of equipment.
Simplified aqueous modeling and computational approaches using approximation are usually ineffective, and can be potentially dangerous, when applied to real process applications. Aqueous systems often behave in complex and unpredictable ways, introducing great risk into plant design and
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Introduction
operation if they are not adequately understood and accounted for. On the other hand, reliable electrolyte models can ultimately provide tremendous insight, process alternatives, efficiencies in plant design, trouble-shooting, and optimization. This improves process economics, reliability, versatility, and meets environmental constraints. The Aspen HYSYS-OLIHYSYS-OLI Interface package is based on OLI Systems software that provides clients with a theoretical framework, databases, data regression techniques, and applications software that comprehensively and accurately simulates and predicts electrolyte systems. The Aspen HYSYS-OLI Interface approach allows you to access OLI components and the OLI Engine, which is distinguished by the following unique elements: Complete speciation. The OLI model predicts and considers all of the true species in a solution, and accounts for these in the computations. Robust standard state framework. Based on the Helgeson equation of state and parameter regression and proprietary estimation techniques, the OLI model provides accurate equilibrium constants and other standard state properties over the broadest possible aqueous range of conditions. Activity coefficients for complex, high ionic strength systems. Based on the combined work of Bromley, Zemaitis, Meissner, Pitzer, and OLI technologists, OLI models can predict behaviour under real world conditions. Comprehensive databank. The Databank covers 79 inorganic elements and their associated compounds and complexes, and over 3000 organic chemicals. For customized coverage of clients' chemistry and private databanks, contact OLI Data Service. Thermo-physical properties. OLI has developed unique chemical-physical based models to compute thermodynamic and transport properties for complex aqueous environments and are provided by the Aspen HYSYS-OLI Interface.
This unique and powerful electrolyte capability provides benefits in profitability through a host of applications in the oil and gas, chemicals, government research, pulp & paper, metals and mining, pharmaceutical, petroleum, and energy industries as has been the case of past OLI clients. The Aspen HYSYS-OLI
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Interface package can be applied to many real industry applications, which are listed below.
Examples of the Aspen HYSYS-OLI Interface Applications Emergency Chlorine Scrubber Caustic Wash Tower Acid Stream Neutralization Removal of Fluoride Ions from Waste Water Scrubbing Refinery Process Streams with DEA Chlor-Alkali Brine Treatment Ahlstron NSSC "Stora" Process Tower Scale Control Foul Feed Stripper Multi-Effect Evaporator Cooling Tower Coke Oven Gas MSF Desalination Plant Dregs Washer and Clarifier Hazardous Waste Deep Well Disposal Contaminated Ground Water Management Organic Acid Removal in Brines BTEX Stripper
Ammonia Still
Aspen Technology Inc., in co-operation with OLI Systems is pleased to provide these capabilities in the Aspen HYSYS-OLI Interface package.
1.2 Aqueous Electrolyte Systems

The Aspen HYSYS-OLI Interface package provides the OLI facilities that allow the user to avoid complexities associated with aqueous electrolyte systems. This means that the user never has to: write an equilibrium reaction. define a true species in the aqueous phase (the user only provides the customary molecular chemical components). deal with any complexities associated with solving for the occurrence of other physical phases in addition to the aqueous phase. carry out any data regressions to develop model coefficients (these are all provided by the OLI databank).
Essentially, the description of process streams and process units is no different than with conventional simulation. For example, the following section details the use of a highly complex system
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Aqueous Electrolyte Systems
of H2O/FeCl3 in which the user only deals with a two component system. Behind the scenes, the OLI software deals with the 14 true species in solution, the 10 equilibrium reactions in the aqueous phase, and the physical equilibrium between the aqueous phase and other phases. This may occur for any solid, vapour, and second liquid phase. The following sections will describe the complexities associated with aqueous electrolyte systems.
1.2.1 Speciation of Aqueous Electrolytes

Aqueous systems often behave in complex ways and introduce great risk into plant design and operation if not understood and accounted for. Electrolytes in water are challenging because many chemicals react with water to form one or more new species via chemical equilibrium reactions. The resulting process is often termed speciation. A particularly complex system occurs when a single chemical compound, like ferric chloride (FeCl3) is dissolved in water. This results in 14 different species and a number of independent equilibrium reactions within the aqueous phase, which are listed below.
FeCl3 Species within the Aqueous Phase H+, OH-, Cl-, Fe3+, FeCl2+, FeCl2+, FeCl3, FeCl4-, FeOH2+, FeOH2+, FeOH3, FeOH4-, H2O, HCl Independent Equilibrium Reactions within the Aqueous Phase H2O = H+ + OHHCl = H+ + ClFe
3+
FeCl3 + Cl- = FeCl4Fe3+ + OH- = FeOH2+

2+ +
+ Cl = FeCl
+
FeOH2+ + OH- = FeOH2+ FeOH2+ + OH- = FeOH3 FeOH3 + OH- = FeOH4-
FeCl
2+
+ Cl = FeCl2 + Cl= FeCl3
FeCl2
The specific roster of species is usually confirmed by experimental means. Together, this process of aqueous speciation via reaction and the
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physical equilibria with other phases, can produce unpredictable results. For example, one mole of ferric chloride dissolved in water produces a solution with a pH of approximately 2, making ferric chloride in water a fairly strong acid. This non-intuitive result occurs when OH- combines with Fe3+ via a series of stepwise reactions, as shown in the above reactions. The depletion of hydroxide ions then causes the water dissociation equilibrium reaction to act to the right liberating more hydrogen ions.
Refer to Chapter 2 Examples of OLI Prediction for a detailed discussion and comparison of OLI predicted and experimental results for this system.
Now, imagine the complexity of not just a single chemical compound in water but, rather, several compounds in a multicomponent system. The opportunity for equilibrium reactions increases in such systems. An important and uncountable multicomponent system is the four-component system waterammonia-carbon dioxide-hydrogen sulfide. In this case, the list of species and reactions in the aqueous phase include the following.
Multi-Component System within the Aqueous Phase H2O, H+, OH-, CO2, CO32-, HCO3-, NH3, NH4+, NH2CO2-, H2S, HS-, S2Independent Equilibrium Reactions within the Aqueous Phase H2O = H+ + OHCO2 + H2O = H+ + HCO3HCO3 =
-
NH2CO2- + H2O = NH4+ + CO32H2S = H+ + HSHS- = H+ + S2OH2-
H+
+ CO3
NH3 + H2O =
NH4+
If the seven aqueous speciation equilibrium reactions (above) are ignored, and the standard thermodynamic properties for the VLE between H2O, CO2, NH3, and H2S in the aqueous and gas phases are taken, the errors in predicting VLE will be as high as several orders of magnitude. The errors are shown in the figure
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below with some points exceeding three orders of magnitude.

Figure 1.1
Based on complete speciation in the aqueous phase, a robust thermodynamic framework, and a supporting databank, the OLI prediction can be accurately illustrated and is shown in the figure below.
Figure 1.2
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Electrolytes are not only formed by inorganic salts (e.g., FeCl3) and gases (e.g., ammonia), which dissolve in water. Many organic acids (e.g., formic acid) as well as other organic compounds dissociate in water and form ions. In addition, the resulting ions may form new species called complexes, ion pairs, or organo-metallic complexes by combining with metal ions. Many other organic compounds dissolve in water without dissociating. For almost all chemical compounds that dissolve in water, there are limits to their solubility. This solubility varies when other chemical compounds are present as well. Any attempt to dissolve more than the solubility limit will result in partitioning of the chemical compound to another physical phase. At room temperature, for example, this may be a solid phase in the case of dissolving sodium chloride, a gas phase in the case of carbon dioxide, or a second liquid phase in the case of benzene.
It is a formidable challenge to grasp a complete picture of thermophysical properties, speciation, and partitioning to other phases for a mixture of chemicals in water. The keys to solving this problem in the form of a predictive model is to obtain the correct speciation and then utilize state-of-the-art models to represent relevant thermodynamic properties of all species in the aqueous and related phases.
1.2.2 High Ionic Strength Systems

High ionic strength systems are particularly problematic for simple thermodynamic approaches. Previously, complexities of speciation for aqueous electrolyte systems were discussed. It is important to realize that these complexities are much more significant for systems with many components at high concentrations. Simplified methods are sometimes used for highly dilute systems, however, these methods are not valid for higher concentration multi-component systems typical of real industrial processes. For example, the unity activity coefficient
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( = 1 ) assumption can lead to substantial errors as shown in the figure below.

Figure 1.3
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At high concentrations, interaction of ions and molecular species with each other make the solvent very significant, which cannot be ignored. In addition, at high concentrations, the formation of complexes, as well as multi-component chemical interactions make accurate model prediction difficult. The OLI framework is the only one in existence that incorporates a robust, predictive activity coefficient model that can accommodate these severe non-idealities. Furthermore, the OLI in-place Databank includes coefficients resulting from thousands of data regressions based on the best available thermodynamic data for binary and many ternary systems. The accuracy of the OLI predictions is illustrated by the effect of temperature, pressure, and concentration in the figure below.
Figure 1.4
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1.2.3 Process Application

Thorough understanding of aqueous electrolytes provides benefits, features, capabilities, calculations, and functionality for chemical process industries. Consider a process application in which chlorine, a component of an off-gas product, is to be scrubbed with (10% by weight) sodium hydroxide solution. Several operating issues have evolved from this application. Given the current design configuration, the scrubbing efficiency is low.
Figure 1.5 Flow Control
Scrubbing Liquid
Caustic Scrubber
Scrubbed Gas
Off Gas
Waste Liquid
The plant operators increased the sodium hydroxide concentration from 10% (by weight) to 20% (by weight). In addition, the Waste Liquid from the scrubber was desired to have a pH > 8.3 for alkalinity control. The result of the change in concentration resulted in frequent fouling of the scrubber and an inability to control the pH. Using the Aspen HYSYS-OLI Interface package, plant operators found that increasing the concentration of sodium hydroxide to 20% (by weight) was inadequate in increasing the scrubbing efficiency.
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The amount of chlorine removal is limited to approximately 50% at sodium hydroxide concentrations greater than 15% (by weight), as illustrated below.
Figure 1.6
Plant operators noticed that the column fouled frequently at the high concentrations of sodium hydroxide, and that the off-gas contained carbon dioxide as well as chlorine. Using the OLI_Electrolyte package, plant operators found that sodium bicarbonate was created when the sodium hydroxide concentrations was increased. At the 20% by weight concentration of sodium hydroxide, sodium bicarbonate (a solid) begins to form as illustrated in the figure below.
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The plant operators confirmed the presence of this solid in their scrubber.
Figure 1.7
Another problem was that the specification of a pH > 8.3 could not be maintained. The Aspen HYSYS-OLI Interface package determined the pH response of the chemistry underlying the process. The pH levels off at approximately 7.0 as the concentration of NaOH increases. This levelling effect is common in aqueous chemistry and is due to the presence of solid NaHCO3 forming inside the scrubber. As long as this solid continues to form, the pH cannot increase as shown below.
Figure 1.8
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Due to a lack of understanding of aqueous electrolyte systems amongst the chemical process industry, the ability to predict properties (e.g., pH) and phase separations associated with aqueous-based chemical systems is limited. In a limited number of situations (e.g., sour water systems) there are some correlations available for predicting VLE or SLE for aqueousbased systems. Designs and/or plant operations are usually based upon very conservative approaches (e.g., over-design) to avoid problems that could be predicted and avoided with the use of the Aspen HYSYS-OLI Interface package. A typical example is scaling in tower units. The formation of salts can result in scale formation within a tower, which will reduce a tower's effectiveness and, eventually, require shutdown of the unit and even the plant. With the OLI model, such salt formation is readily predicted and thus avoids altering operating conditions, the level of use of a reagent, or the addition of a scale inhibitor. All of these can be predicted via the Aspen HYSYS-OLI Interface package based on OLI models.
1.3 Gibbs Free Energy

Refer to Chapter 3 Aqueous Thermodynamics for detailed information on aqueous thermodynamics used in the Aspen HYSYS-OLI Interface package.
There are five principal partial molal properties in each phase that will be discussed. They are the: Gibbs Free Energy Enthalpy Entropy Heat Capacity Volume
In particular, the focus is on the aqueous phase for which the thermodynamic approach is not well understood. The key to thermodynamic equilibrium in the aqueous intraphase speciation equilibria and the physical equilibria between phases is the Gibbs free energy (chemical potential). For every thermodynamic equilibrium reaction, the total Gibbs free energy for the species on the left side of the reaction must be equal to the total Gibbs free energy on the right side of the reaction.
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Gibbs Free Energy
An example of such a reaction is shown below.

CO 2 + H 2 O H + HCO 3 G CO + G H
2 2O
(1.1) (1.2)
= G
+G
HCO 3
where: G = Total Gibbs Free Energy

Refer to Section 3.5 Standard State for more information on the defined Standard State.
The total Gibbs free energy can be further defined in terms of a Standard State Gibbs free energy (Go) and an activity (a) as follows:
G i = G i + RT ln(a i ) where: R = Gas Constant T = Absolute temperature (1.3)
Note that this definition is in terms of an activity rather than a concentration. To write this in terms of concentration, the notion of activity coefficient needs to be introduced, which captures the departure from ideality. In other words, the relationship between the activity of a species and the concentration of that species.
ai = i mi where: = activity coefficient m = concentration unit molality (aqueous systems) (1.4)
Molality is defined as the number of moles of a species in a kilogram (approx. 55.508 moles) of water. Defining concentration in this way makes the concentration definition independent of density and therefore, temperature.
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The standard state used for aqueous-based systems is the one most commonly used in literature. For any species other than water, the standard state is the concentration of a hypothetical one-molal solution of the species extrapolated to infinite dilution. This standard state is termed asymmetrical and is a function of temperature and pressure only. Rewriting Equation (1.3):
Gi = Gi + Gi where: GiE = Excess Gibbs Free Energy (RT ln(a))
E
(1.5)
There are similar expressions to Equation (1.5) for all five principal partial molal properties. The other four (enthalpy, entropy, heat capacity, and volume) property expressions can be written as:
E
H = H + H S = S + S
(1.6) (1.7)
E
Cp = Cp + Cp V = V + V
E
(1.8) (1.9)
For Gibbs free energy, the excess term was directly related to the activity coefficient. For the other four properties, denoted above, the excess terms all relate to various partial derivatives of the activity coefficient. For example, the excess enthalpy directly relates to the first partial derivative of the activity coefficient with respect to temperature. The Aspen HYSYS-OLI Interface aqueous thermodynamics is based on the OLI framework and detailed in Chapter 3 - Aqueous Thermodynamics.
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OLI Thermodynamic Framework
1.4 OLI Thermodynamic Framework

Refer to Chapter 3 Aqueous Thermodynamics for detailed information on Aqueous thermodynamics used in the Aspen HYSYS-OLI Interface package.
OLI has developed a thermodynamic formulation for the thermodynamic properties (Gibbs energy, enthalpy, etc.) discussed in Section 1.3 - Gibbs Free Energy. The formulation is based on the Helgeson framework for the standard state terms and Bromley, Zemaitis, Pitzer, DebyeHuckel, and others for the excess terms. The predictive nature of the OLI model is based upon the work of Harold Helgeson and co-workers. Helgeson and others have developed a predictive equation of state for the prediction of the partial molal standard state properties of any species within the aqueous phase. Dimitri Sverjensky contributed greatly in providing methods for estimating the coefficients of the equation of state for species where it is not practical to regress for the required coefficients. It is beyond the scope of this document to provide the specific formulas for the five principal standard state terms, however a general description is shown below.
G = G ( T, P, , c 1, c 2, a 1, a 2, a 3, a 4 ) H = H ( T, P, , c 1, c 2, a 1, a 2, a 3, a 4 ) S = S ( T, P, , c 1, c 2, a 1, a 2, a 3, a 4 ) Cp = Cp ( T, P, , c 1, c 2, a 1, a 2, a 3, a 4 ) V = V ( T, P, , c 1, c 2, a 1, a 2, a 3, a 4 ) (1.10)
The parameters shown in each equation are equation of state coefficients that are unique to each species. In many cases, a1 through a4 can be ignored since these coefficients relate only to the effects of pressure on the properties of interest, and until pressures get above 100 atmospheres the effects of pressure are negligible. OLI has incorporated a Helgeson framework and estimation methods that allow data banking for the , c1, and c2 for virtually any species in water and a1 through a4 for most cases. Remember that equilibrium constants depend solely on
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the individual G values for the constituent species in each reaction. The OLI framework based on Helgeson can predict these individual G values for any species in water, and therefore, can also predict any equilibrium constant. This fully predictive framework for standard state properties relieves the historic burden of speciation from the activity coefficients. Thus, the remaining compositional effects (called non-ideality) are placed on the activity coefficients without the speciation equilibrium. As noted earlier, the excess properties relate to the activity coefficients. OLI's model for activity coefficients of ions has the following form:
= DH (I) + BZ (I,T,m) (1.11)
where: DH = Debye-Huckel term which is a function of ionic strength BZ = Bromley-Zemaitis term which is a function of ionic strength, temperature, and the individual species concentrations represented by m (the vector of species molalities) I = ionic strength which is directly related to various ionic concentrations
The Debye-Huckel term completely describes the activity coefficient for very dilute systems.
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Other Physical Phases in
1.5 Other Physical Phases in Equilibrium

Refer to OLI_Electrolyte Options (in Chapter 2 Fluid Package of the Aspen HYSYS Simulation Basis guide) for information on including or excluding phases in Aspen HYSYS simulations.
The Aspen HYSYS-OLI Interface package based on the OLI model takes into account the possible occurrence of other phases in equilibrium with the aqueous phase. It also provides databank support so that all required thermodynamic calculations are carried out automatically. Almost any solid that might form from an aqueous mixture is accounted for since the OLI model can simultaneously consider up to 250 possible solids that might precipitate from a mixture. In reality it is rare that more than five solids will actually precipitate at one time, but the model will correctly predict the precipitating solids. In addition, the model accounts for possible formation of a gas phase and a second (non-aqueous) liquid phase. The condition for physical equilibrium between phases is that the total Gibbs free energy (chemical potential) is equal for the phases in equilibrium. The manner in which OLI calculates Gibbs free energy for the aqueous phase was established in Section 1.3 - Gibbs Free Energy. In this section, the OLI calculation of the Gibbs free energy for solids, gases and a second liquid phase will be described.
Refer to Section 3.7 Multi-phase Model for detailed information on multiphase equilibrium models used in the Aspen HYSYS-OLI Interface package.
Each solid in equilibrium with the aqueous phase is an independent phase, therefore, the Gibbs free energy is calculated for individual solids. This is shown in the classical thermodynamics definition in the following equation:
T P
Gs =
Tr Gs
Tr Ss ( T
Tr ) +
Cp dT + V dP
Tr Pr
(1.12)
where: Tr = reference state temperature of 298.15 K
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For the gas and second liquid phase, the OLI model uses an enhanced SRK formulation for the thermodynamic properties. For the free energy, the classical formulation is used and shown below:
G i = G i + RT ln(f i c i P) where: fi = fugacity coefficient of species i in the gas or non-aqueous liquid phase ci = mole fraction of species i in the gas or non-aqueous liquid phase (1.13)
1.6 Aspen HYSYSOLI_Electrolyte Property Package

The Aspen HYSYS-OLI_Electrolyte property package models aqueous, conventional and other complex chemical systems. This package was developed in co-operation with OLI Systems, Inc. Through Aspen HYSYS, it allows you to access the OLI component databases as well as to the OLI engine for the automatic generation of the electrolytes chemistry model. OLI_Electrolyte is an available property package option within the Simulation Basis Manager in Aspen HYSYS. The OLI_Electrolyte property package can model complex chemical phenomena, including:
Refer to Chapter 3 Electrolyte Operations in the Aspen HYSYS Operations Guide for detailed information on unit operations.
Intraphase Equilibria between aqueous, organic, vapour and solid phases. Intraphase Equilibria including redox and speciation reactions.
Three unit operations and a rigorous electrolytes column have been added to Aspen HYSYS for use in simulations involving electrolytes. The unit operations include the Neutralizer,
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Aspen HYSYS-OLI_Electrolyte
Crystallizer, and Precipitator which are detailed in the Aspen HYSYS Operations Guide.
1.6.1 Electrolyte Calculation Techniques

The OLI_Electrolyte property package uses a highly advanced thermodynamic and mathematical framework for predicting the equilibrium properties of a chemical system. This predictive framework is based upon:
Refer to Chapter 3 Aqueous Thermodynamics for detailed information on thermodynamic calculation methods.
The revised Helgeson equation of state for predicting the standard state thermodynamic properties of all species, including organics, in water. The Bromley-Zemaitis framework for the prediction of excess thermodynamic properties. The Pitzer and Setschenow formulation for the prediction of the excess thermodynamic properties of molecular species in water. The enhanced SRK equation of state for the prediction of vapour and non-aqueous liquid phase thermodynamic properties. This enhanced equation of state applies to organics which are sparingly soluble in water, and which form a second liquid phase that is nearly ideal.
1.6.2 Electrolyte Components

Refer to Section 1.2.4 Adding Electrolyte Components in the Aspen HYSYS Simulation Basis guide for information on adding database components to a Aspen HYSYS simulation. Refer to Section 1.8 Aspen HYSYS-OLI Interface Component Databases for more information on component databases.
All electrolyte features are accessed through the Aspen HYSYS interface. This package does not use the Aspen HYSYS component databases, but rather accesses the OLI databases, which include information required for generating the chemistry models. There are two databases available with this package. Each database offers identical Aspen HYSYS functionality but differs with regard to the number of available components. Limited. The standard 1,000 component databank. Components in this database are of most interest to the process industries. The electrolytes limited database is a subset of the Full database. Full. An extended 3,000 component electrolyte database. The Full database also includes the GEOCHEM (mineral components) electrolytes database.
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The following functions are not supported in Aspen HYSYS when using the OLI_Electrolyte property package compared to the traditional components. Classification of components is based on their type; all components are classified as miscellaneous (you can not use the family filter). The Synonym, formula, and name columns in the component selection form are the same. Oil mixtures and hypothetical components are not available. To add hypothetical components, a private database must be created and specified in the Private User Database option.
If water is not added or selected as a component, Aspen HYSYS will add it automatically.
1.6.3 Chemistry Model Generation

When all components are selected, Aspen HYSYS automatically generates the chemistry model which is required to perform flash calculations. Aspen HYSYS predicts all possible species in each phase that could exist in the chemical system defined by the selected components and the optional phases and adds them to the chemistry model. When the model has been successfully generated, the OLI Engine is initialized via the Initialize Electrolytes Environment button in the Fluid Package Basis property view and calculations begin.
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1.6.4 Electrolytes Nomenclature

To accommodate the electrolyte package in Aspen HYSYS, some Aspen HYSYS nomenclature has been modified and properties have been added. Key properties pertaining to electrolyte simulations, such as pH, molality, ionic strength, osmotic pressure, heat capacity, and viscosity may be accessed through the Electrolytes page on the Worksheet tab for a stream operation. The Aspen HYSYS specifications have also been modified to accommodate the characteristics of the electrolyte system by incorporating both molecular and ionic component information. When discussing the components in a Aspen HYSYS-OLI Interface case, it is necessary to distinguish between two different sets of species: Apparent (or molecular) species. True includes apparent and ionic species.
Apparent (Composition page) and True Species (Electrolytes page) can be found on the Worksheet tab of the stream property view for electrolyte simulations.
The apparent components include all molecular components that are either selected, or may form through ionic reactions. The apparent components do not include any ions that may be formed through reaction of the components. The apparent species are a subset of the true component group. The true species or components include all of the apparent species as well as ions formed through reactions or dissociation in the aqueous phase.
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As an example, a user specifies a fluid containing apparent components H2O, NH3, and H2S. The ionic reactions may be given as:
H 2 O H + OH
+ + -
NH 3 + H 2 O NH 4 + OH H 2 S H + HS HS H + S
+ + -
(1.14)
2-
The apparent species are H2O, NH3, and H2S. The true species include the apparent species as well as H+, OH-, NH4+, HS-, and S2-.
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1.6.5 Electrolyte Properties

The true species properties can be found on the Electrolytes page of the Worksheet tab (Stream Property View) in a Aspen HYSYS simulation case.
There are properties used in this documentation which are specific to electrolytes chemistry and are not commonly referred to in other Aspen HYSYS documentation. In order to facilitate the use of this documentation, some of these properties are defined in the following table:
Property Molal Concentratio n pH Description The number of moles of solute per kilogram of solvent. In Aspen HYSYS, the solvent is always water. Expresses the acidity of aqueous solutions. It is calculated by taking the negative logarithm of the hydronium ion in a solution:
pH = log [ H 3 O ] 1 pH = log -----------------+ [ H3 O ]

The greater the acidity of a solution, the lower the pH value. Likewise, the more basic a solution, the higher the pH. Although the pH scale is typically considered to range from 0 to 14 with a completely neutral solution having a pH of 7, pH may extend beyond the general scale. This includes negative pH values for very acidic solutions, and pH values greater than 14 for extremely basic solutions. Ionic Strength A value which relates to the charge of a solution given by the equation:
I = 0.5 c i z i
where: I = ionic strength ci = concentration of the ion i zi = charge of the ion i
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Property Osmotic Pressure
Description Osmosis is the process by which solvent passes spontaneously through a semi-permeable membrane, separating solutions of different concentration from the region of lower solute concentration to the region of higher solute concentration. Solvent molecules pass from the region of higher concentration to that of lower concentration, but the net rate of solvent flow is from the lower to higher concentration regions. There will continue to be a net flow rate of solvent particles through the membrane as long as there is a concentration gradient across the membrane or until the hydrostatic pressure from the solution of greater concentration forces solvent particles against the gradient to equalize the flow rate. The hydrostatic pressure exerted under this condition is called the osmotic pressure. The osmotic pressure, , of a solution is dependent on the number of solute particles present in the solution. For dilute aqueous solutions, the equation is:
= MRT
where: M = molarity of the solution R = ideal gas constant T = temperature of the solution Temperature of the solution is significant because it affects the number of solvent-membrane collisions per unit time.
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Property Specific Electrical Conductivity
Description The specific electrical conductivity is expressed in the following relation:
lLs = L -A
where: L = electrical conductivity (1/ohm) l = length of the conducting media (m) A = cross sectional area of the conducting media (m2)
Molar Electrical Conductivity
The molar electrical conductivity is expressed in the following relation:
1000 = Ls ----------CN
where: Ls = specific electrical conductivity CN = concentration of the electrolyte solution
1.6.6 Disabling Solid Components

Refer to OLI_Electrolyte Options (in Chapter 2 - Fluid Package of the Aspen HYSYS Simulation Basis guide) for more information on including and excluding solid components.
When the solid phase is included in a case, the electrolytes engine generates a model that predicts all possible solid species, including hydrates, for the system. Depending on the number of components in the case, a model that is difficult for the system to efficiently handle may result. Aspen HYSYS allows you to disable any of the solid components in a case via the OLI_Electrolyte Property Package Basis property view. Selective disabling of solid components that are not of interest to a simulation result in faster execution and convergence times. To disable solid components from a case, select the Selected Solid button in the Fluid Package Basis property view for the OLI_Electrolyte property package. Once
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selected, the Selecting Solid property view appears with all of the predicted precipitates and hydrates for the case. Aspen HYSYS also allows you to disable solid components for a particular stream. Any solid in a stream may be excluded by selecting the Solid radio button in the Phase group of the Electrolytes page of the stream property view. Disable the solid by clicking on the Include checkbox for the particular solid(s) to be removed from the calculations. After disabling any solid(s), trigger the solver so it performs a stream flash excluding these solid(s) in the calculation. When solid components are excluded, Aspen HYSYS is required to recalculate the model before you proceed with a case. You can consult the calculated scaling tendency of a solid (described in the next section) to determine its significance to the case.
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1.6.7 Scaling Tendencies

Refer to Section 3.8 Scaling Tendencies for the thermodynamic calculation techniques.
The scaling tendency of a solid refers to its tendency to form at the specified stream conditions. Solids with a scaling index greater than one will form if: the solid formation is governed by equilibrium (as opposed to kinetics) there are no other solids with a common cation or anion portion which also has a scaling tendency greater than one.
If more than one solid exists with a common ion and the scaling tendencies are greater than one, then at least one of the solids will form. Scaling indices can be used to determine which solids can be safely removed from the model. The scaling index of a solid is calculated with stream properties and can be viewed by selecting Properties for the True Species Info group and selecting Solid as the phase on the electrolytes stream property view.
1.6.8 Aspen HYSYS Column Operation

For a detailed description of the column unit operations, refer to Chapter 3 - Electrolyte Operations in the Aspen HYSYS Operations Guide.
The electrolytes column characteristics are very similar to those of any Aspen HYSYS column available using other available Aspen HYSYS property packages. Column conventions, commands and methods by which you create and run the columns are, for the most part, the same in the Aspen HYSYSOLI Interface. However, there are some important differences that must be discussed to aid in the building and running of the column within this package. This section will cover only those column methods that differ from the traditional functions of the Aspen HYSYS column.
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Basic Column Configurations

There are five basic types of column templates available for the OLI_Electrolyte property package: Distillation Column Refluxed Absorber Absorber Reboiled Absorber Liquid-Liquid Extractor
When using the electrolytes package, you cannot modify the column templates as you can in the standard Aspen HYSYS column environments. Insert a column as you would any unit operation by selecting it from the object palette or by adding an operation through the Flowsheet menu. The input fields that appear are similar to the standard Aspen HYSYS column fields with the following exceptions: Flows can only be specified on a mole basis. Although, the displayed results can be viewed on a molar, mass, or liquid volume. basis. Exchanger duties must be specified for column operations.
Plots
The Plots page can be accessed from the Performance tab of the column environment. Tray by tray electrolyte properties can be viewed either in a graph or table by selecting the Electrolyte Properties option. Electrolyte property profiles can be seen versus tray number for pH, ionic strength and if there are solids - the scale index profiles can be viewed.
For more information on true and molecular species, refer to Section 1.6.4 Electrolytes Nomenclature.
The Electrolytes group allows you to select between True Flow and Molecular Flow for viewing property profiles. True flow includes ionic effects as well as molecular species. Molecular (apparent) flow includes molecular components either selected or which form from ionic reactions. They do not include ionic effects that are formed through reactions. All other property views inside the column environment represent True flow.
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Column Specifications
The biggest difference you will most likely encounter when adding a column to a case using the OLI_Electrolyte property package involves the methods by which column specifications are defined and changed. OLI columns have pre-defined specifications, where as, traditional Aspen HYSYS columns are flexible. With the OLI_Electrolyte package, specifications are for the most part not replaceable like Aspen HYSYS packages. An Electrolytes column has a set of variables, which depending on the equipment, must be specified. The following table lists the column equipment and the specifications required when added to a column:
Equipment Side Draw Side Exchanger (Condenser, Reboiler) Pump Around Feeds Pump Around Rate and Duty 5 Pump Arounds 10 Feed Streams Specification Draw Rate Exchanger Duty OLI Restrictions 10 Draws
It should be noted that pump arounds are also considered to be draws. Therefore, if you have five pump arounds, you can specify five more draws. Additionally the following should be noted: Tray Efficiencies. The Murphree tray efficiency for all stages may be specified. The efficiencies can be specified on a stage-by-stage basis. They can also be specified by component efficiency type as well as overall efficiency. Total Condenser. The distillate rate, reflux rate and reflux ratio may be specified. In order to install a total condenser, a column with a condenser should be installed and Total should be selected as the condenser type. Simultaneously, appropriate specifications (distillate rate, reflux rate or ratio are installed and activated). The decanter is only available with organic liquids (two liquid phase). Aqueous liquids are refluxed and the organic liquid is flashed and drawn out in the condenser. Pump Arounds. Pump arounds operate from the bottom (draw) to the top (return) stage for the Aspen HYSYSOLI Interface. Pump arounds cannot overlap, that is, the draw stage must be on a higher stage than the previous
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pump around return stage. Also, pump arounds require aqueous liquids only. Standard Aspen HYSYS is flexible and allows the user to operate pump arounds from higher stage to the lower stage or from the lower stage to the upper stage.
OLI Specs
Although, the electrolytes column specifications are fixed, control variables may be added for the fixed specifications. A control variable is an active specification that adjusts to reach the value of the target specification. For instance, a side draw on an absorber requires that the draw rate be specified. A control can be set over the draw rate specification so that another variable can be specified. A control may be the flow rate of a particular component in the stream, or the stream temperature. When the column solves, the side draw rate will be adjusted to meet the target specification. A list of the available target specifications include: Tray Tray Tray Tray temperature vapour, liquid, or side draw flow rate vapour, liquid, or side draw component flow vapour, liquid, or side draw component fraction
The following are active spec control variables: Draw flow Pump around flow Duty Pump around duty
Active spec control variables can be accessed via the Specs page of the Design tab in a column environment.
It is important to remember that when a control variable is added over a specification, the specification becomes an initial guess. Therefore, you should keep in mind that even though a control variable is being placed over a specification, the specification value is important as a good initial guess will help Aspen HYSYS calculate the column quickly and efficiently.
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The available target specifications property view has the OLI Spec button. This button activates where you can specify control variables and set the Active status of the OLI spec. This can also be done from the Specs Summary page. Although the process of adding controls over specifications in the Electrolytes package seems restrictive compared to the usual Aspen HYSYS column specification method, it is actually an equivalent method. The difference is that the usual Aspen HYSYS algorithm formulates the specifications directly into the column solution. The column algorithm used in the Electrolytes package does not have the specifications built into the solution and therefore the column formulation is built with a fixed set of variables that includes the basic specifications. Initial guesses are required for the basic variables. As such, the column requires specifications for all the basic column parameters.
Column Streams
It should be noted that column streams may have slightly different results compared with stream flash results. You can cross check between the two stream results via the object navigator in the Flowsheet menu. The internal (COL) column stream results are directly based on the OLI column solver. The external stream results are calculated by the stream flash. Also, osmotic pressure, heat capacity and viscosity properties are not calculated internally in the column, but rather calculated by the stream flash.
1.6.9 Electrolyte Stream Flash

The electrolyte stream flash differs from the Aspen HYSYS material stream flash to handle the complexities of speciation for aqueous electrolyte systems. The Aspen HYSYS-OLI Interface package is an interface to the OLI Engine (OLI Systems) that enables simulations within Aspen HYSYS using the full functionality and capabilities of the OLI Engine for flowsheet simulation. When the OLI_Electrolyte property package is associated with
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material streams, the streams exclusively become electrolyte material streams in the flowsheet. That is, the stream conducts a simultaneous phase and reaction equilibrium flash. An electrolyte material stream in Aspen HYSYS can perform the following types of flashes: TP Flash PH Flash TH Flash PV Flash TV Flash
Due to the involvement of reactions in the stream flash, the equilibrium stream flash may result in a different molar flow and composition from the specified value. Therefore, mass and energy are conserved for an electrolyte material stream against the Aspen HYSYS stream for mass, molar and energy balances. Limitations exist in the Aspen HYSYS-OLI Interface package in the calculation of the stream flash results. The calculation for the electrolyte flash results must fall within the following physical ranges to be valid:
Refer to Section 1.8.3 Special Databases on LOWTEMP for more information.
composition of H2O in aqueous phase must be > 0.65. Temperature must be between 0 and 300C. Pressure must be between 0 and 1500 atm. Ionic strength must be between 0 and 30 mole/kg-H2O.
A additional low temperature database that extends the range to -50 to 300C can be added.
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Range of Applicability
1.7 Range of Applicability

The Aspen HYSYS-OLI Interface package supports predicted frameworks and calculates (flash) equilibrium for aqueous systems. The package allows chemical systems to be accurately simulated over the following conditions.
1.7.1 Aqueous Systems

The range of applicability for an aqueous system is shown in the table below:
Properties Temperature Pressure Mol Fraction of water within the aqueous liquid phase Ionic Strength Refer to Section 1.8.3 Special Databases on LOWTEMP for more information. Aqueous Systems 0 - 300C 0 - 1,500 atm 0.65 - 1.0 0 - 30 molal
A additional low temperature database that extends the range to -50 to 300C can be added.
1.7.2 Non-Aqueous Liquid

Currently, there are no separate activity coefficient models available, for example, the NRTL, UNIFAC, or UNIQAC. Non-aqueous and vapour fugacity coefficients are determined from the Enhanced SRK1 Equation of State. 2 vapour critical parameters (Tc, Pc, Vc, and ) are correlated to find a fugacity coefficient.
1. G. Soave. Chem.Eng. Sci.27,1197(1972) 1-36
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1.7.3 Gas & Second Liquid Phase

The OLI model that is used for the gas phase and second liquid phase is based on an enhanced SRK equation of state. Due to the limits of the SRK equation of state, certain non-ideal second liquid phases may not be predicted accurately.
1.7.4 Multi-Component Systems

Another limitation is for multi-component systems with more than three components plus water. The OLI model includes data regression for an enormous number of chemical systems and is provided in the Aspen HYSYS-OLI Interface package. In general, all single components plus water have been regressed. The accuracy of typical binary system predictions at different temperatures are illustrated in the figures below:
Figure 1.9
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Range of Applicability
Figure 1.10
Refer to Chapter 2 Examples of OLI Prediction for other examples of predicted data fits.
In addition, many ternary systems (water plus two other components) have been regressed together with the constituent binary systems. The ternary system predictions compared to experimental data are illustrated in Figure 1.11 and Figure 1.12.
Figure 1.11
Figure 1.12
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In Figure 1.12, the unusual behaviour of gypsum at 25C and high NaCl concentrations (there is a maximum gypsum solubility at an intermediate NaCl concentration) should be noted. This behaviour could not be predicted with less rigorous models, but is accurately predicted by the Aspen HYSYS-OLI Interface package using OLI models. For regressed systems, the error between predicted and experimental values is generally less than 10%. For all multi-component systems (with more than three components plus water), the OLI model relies on some estimation/prediction methods. The key to these systems is whether or not the subsystems defined by water together with components present in excess of 1 molal concentration have been subjected to data regression by the OLI framework.
The Aspen HYSYS-OLI Interface package provides well over 100 systems which have been regressed by OLI.
If the system is not, the predictions will usually be good qualitatively but fairly substantial errors (25+%) may result in the actual predictions. For most common ternary systems (e.g., H2O/NH3/CO2, H2O/CO2/NaCl), it is safe to assume that OLI models include the required ternary system regressions.
1.8 Aspen HYSYS-OLI Interface Component Databases

The Aspen HYSYS-OLI Interface package includes the Full database, Limited database and the Special databases (i.e., GEOCHEM, LOWTEMP, and REDOX) components. The Full and Limited databases offer identical Aspen HYSYS functionality but differs with regard to the number of available components. The Special databases extend the range of applicability of the Full database to include unique components (e.g., minerals, and pure metals) and properties under special conditions (e.g.,
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below 0C).
1.8.1 Full Database

The Full database of electrolyte components is listed in Appendix A - Aspen HYSYS-OLI Interface Full Database.
Full database covers 5041 species. In terms of inorganic chemistry, this includes much of the aqueous chemistry in water (including speciation reactions) for 79 inorganic elements from the periodic table (including actinides, heavy and precious metals) and their associated aqueous species. In addition, the databank covers over 3000 organic chemical compounds (including electrolytes, chelates, and organo-metallic species). Computed thermodynamic properties such as pH, ionic strength, enthalpy, density, osmotic pressure are supplied from the database. The aim of the package is to cover any species that is of interest to clients and process industries. However, if a species is missing or does not cover the range of conditions of interest, the OLI Data Service is provided.
Refer to Section 1.8.4 Private User Databases - OLI Data Service to for more information.
1.8.2 Limited Database

The Limited database contains 2,187 standard components that are of most interest to process industries. It is limited and is a subset of the Full database.
1.8.3 Special Databases

Aspen HYSYS supports three OLI special databases: GEOCHEM LOWTEMP REDOX
Refer to Section 1.2.4 Adding Electrolyte Components in the Aspen HYSYS Simulation Basis guide for more information on the Component List property view.
To access the OLI_Electrolyte Additional Database property view, click on the Additional Database button in the Component List property view.
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You can add one or more special databases to the Full database by selecting the special database(s) in the OLI_ Electrolyte Additional Database property view.
Figure 1.13
OLI has a few other databases that are generally distributed with the product. All other Special Databanks that are provided with the OLI Engine (but are not currently in Aspen HYSYS-OLI Interface) are not provided to contribute to the speciation but, rather, help to support the products in other ways.
GEOCHEM
The GEOCHEM electrolyte Database components are listed in Appendix B - Aspen HYSYS-OLI Interface GEOCHEM Database.
The GEOCHEM databank is supported in the Aspen HYSYS-OLI Interface package. The databank is separated from the public since it contains many solids, which only form via thermodynamic equilibrium after long periods of time (often thousands of years). They are solids that form in nature and are often different from the form of a solid that may form in a much shorter amount of time (usually instantly) within a process. Thus, the GEOCHEM solids tend to form through aging of the aqueous environment in contact with a source of the elements comprising the solids.
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LOWTEMP
The LOWTEMP database provides an accurate thermodynamic framework for calculating the physical and chemical properties of multi-phase, aqueous systems at low temperature. The LOWTEMP database covers exactly the same electrolyte components as the Full database, except that the LOWTEMP database extends the applicable temperature range to -50C to 300C.
REDOX
The REDOX database supports calculations involving the reduction and oxidation of pure metals and alloys to simulate the corrosion process in aqueous system. The REDOX chemistry can be studied for real solution, including trace components. Once you activated the REDOX database and selected the desired components, OLI automatically generates a matrix of all possible redox subsystems. Each redox subsystem consists of a collection of species containing a given element in any oxidation state.
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You can activate an individual redox subsystem by performing the following: 1. From the Fluid Package property view, select the Set Up tab.
Refer to Chapter 2 Fluid Package in the Aspen HYSYS Simulation Basis guide for information on adding fluid packages.
2.
In the Property Package Selection group, select the OLI_Electrolyte fluid package.
3. Click on the Redox Subsystem Selection button in the Redox Options group.
Figure 1.14
4. The Redox Sub-Systems property view appears. You can include the desired redox subsystems by selecting their corresponding checkboxes.
Figure 1.15
By default, OLI REDOX selects the redox subsystems that contain metals of engineering importance. This default is motivated by corrosion applications, for which redox transformations of engineering metals are important.
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5. Click on the View Electrolyte Reaction in Trace Window button to view all the electrolyte reactions involved for the selection. If the View Electrolyte Reaction in Trace Window button is disabled, click on the Initialize Electrolytes Environment button in the Fluid Package property view to activate the electrolyte system. In principle, you can select all redox subsystems. However, this will most likely result in time-consuming calculations. Therefore, a careful selection of subsystems is recommended. OLI recommends the following guidelines for selecting redox subsystems: If you are studying the corrosion of any metal, you have to include the redox subsystem corresponding to that metal. Most likely, REDOX will recommend to include that metal as a default. There is a large number of elements that usually occur in only one oxidation state. Metals of the first and second group in the periodic table (e.g., Na, K, Ca, etc.) are a good example. There is usually no need to include such metals in their elemental form. There are some non-metals that may or may be important in the redox equations. A typical example is sulfur. A typical example is sulfur. If you are studying, for example, corrosion of metals in H2S-containing environments, it will be necessary to include the sulfur redox subsystem because H2S may form sulfides, which commonly undergo redox transformations. However, if you are using H2SO4 only as an acid and do not anticipate any redox reactions, you do not have to select the sulfur redox subsystem.
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1.8.4 Private User Databases OLI Data Service

Refer to Figure 1.13 in Section 1.8 - Aspen HYSYS-OLI Interface Component Databases for more information on the OLI_Electrolyte Additional Database property view.
The Aspen HYSYS-OLI Interface package allows you to provide additional databases via the Private Databank in the OLI_Electrolyte Additional Database property view. You can provide your own supplementary databases (Private Database) in addition to the Public (Limited, Full and Special) databases by specifying the path and name of the private database in the Path of Private Database field. After you have located the private database, it will be listed in the Private Database table (see Figure 1.16). You can select the desired private databases by selecting their corresponding checkboxes.
Figure 1.16
For more information on requesting private database services, consult the OLI Systems web site www.olisystems.com.
The private databases can be prepared by users with training but are normally produced by the OLI Data Service. The procedure for customizing databases is to inform OLI Systems that certain chemistry either is not covered or inadequately covered by the Full Database. OLI will then estimate the amount of time and provide quotations for the service. The fee is based upon whether or not OLI can provide public domain information and if OLI can release the results with subsequent releases of its Public Databanks. OLI's Data Service begins all projects with a thorough literature search. After all relevant literature is critically reviewed and the experimental data is fit, nonlinear regression is carried out. As a result of these regressions, databank coefficients are developed.
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OLI Engine
1.9 OLI Engine

The OLI Engine is the essential heart of all OLI software. The Aspen HYSYS-OLI Interface package is an interface to the OLI Engine that enables simulations within Aspen HYSYS using the full functionality and capabilities of the OLI Engine for flowsheet simulation. The OLI Engine is defined as the databanks and solvers that enable the prediction and numerical solution of the underlying chemical and physical equilibria. Therefore, the thermophysical properties and phase separations for almost any mixture of chemicals in water, at almost any conditions are of practical interest to industry. Refer to the OLI Engine manual for more information on OLI Engine Software. This can be obtained by contacting OLI Systems.
The flash conditions for standard Aspen HYSYS-OLI Interface package include T = 0 to 300C, P = 0 to 1,500 atm, Ionic Strength = 0 to 30 molal.
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Examples of OLI Prediction
2-1
2 Examples of OLI Prediction

2.1 Solubility Prediction....................................................................... 2 2.1.1 2.1.2 2.1.3 2.1.4 2.1.5 Sodium Chloride Data ............................................................... 2 Barite Data.............................................................................. 3 Celestite Data .......................................................................... 4 Celestite Solubility versus Temperature ....................................... 5 Gypsum & Anhydrite Data ......................................................... 6
2.2 Speciation in Sour Water................................................................ 7
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Solubility Prediction
2.1 Solubility Prediction

Comparisons of OLI predicted and experimental results for electrolyte systems are provided in this chapter. The Aspen HYSYS-OLI Interface package can indirectly predict the solubility from a stream flash in Aspen HYSYS.
2.1.1 Sodium Chloride Data

OLI's extensive database allows for prediction of virtually all important industrial solids. Below is a plot of the observed versus predicted solubility of NaCl over a broad range of pressures.
Figure 2.1
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2.1.2 Barite Data

OLI Electrolytes accurately predicts the barite solubility over broad ranges of temperatures, pressures, and salinities as shown below.
Figure 2.2
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2.1.3 Celestite Data

Based upon quality fits, OLI Electrolytes software produces accurate predictions of strontium sulfate (celestite) solubility under a variety of conditions. In the two figures shown below, celestite solubility is predicted at two separate temperatures (25 and 71.1C) over the solubility range of NaCl (0 to 6 molal).
Figure 2.3
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2.1.4 Celestite Solubility versus Temperature

The following graphs illustrate the experimental and predicted solubility of calcite at high temperatures, pressures, and NaCl concentrations. It can be seen that OLI accurately predicts calcite solubility over all conditions. This is due to the rigorous approach to computing the thermodynamic solubility of CaCO3, and the activity coefficients for the complete speciation of the ions in solution.
Figure 2.4
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2.1.5 Gypsum & Anhydrite Data

OLI software produces accurate predictions of calcium sulfate solubility under a variety of conditions for the two major crystalline phases. In the two graphs shown below, gypsum (CaSO4.2H2O) and anhydrite (CaSO4) solubility is predicted over the NaCl range of 0 to 6 molal.
Figure 2.5
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2.2 Speciation in Sour Water

This example is for a sour water system (NH3/H2S/CO2/H2O) with the following sour water species.
Sour Water Species Vapour Species Aqueous Neutral Species Aqueous Ionic Species H2O, CO2, H2S and NH3 H2O, CO2, H2S and NH3 H+, OH-, NH4+, HS-, S2-, HCO3-, CO32-, and NH2CO2-
The chemistry can be summarized as:

Vapour - Liquid Equilibrium Reactions (Molecular Equilibrium) H2O(vap) NH3(vap) CO2(vap) H2S(vap) = = = = H2O NH3(aq) CO2(aq) H2S(aq)
Aqueous Chemical Reactions (Electrolyte Equilibrium)* H2O = H+ H2O H+ H+

+
OH= = + + S2
-
NH3(aq) + HCO3
-
NH4+ H+ CO3 = HS2-
CO2(aq) + H2O = + = H NH2CO2H2S(aq) HS

-
HCO3+ HCO3- (hydrolysis of ion)
H2O(aq) +
NH3(aq)
*Note that additional electrolyte reactions are needed.
This example illustrates the importance of considering aqueous reactions and speciation, as well as the compliance of OLI predictions with experimental data. The data contained in the table below compares the experimental partial pressures of carbon dioxide, ammonia and hydrogen sulfide against a VLE only model and the full OLI speciated model.
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Speciation in Sour Water
Figure 2.6
The calculated partial pressures of the gases are over predicted as shown below in Figure 2.7. In the case of ammonia (filled and open diamonds), the over prediction may be as much as five orders of magnitude. If the OLI full speciation approach is not followed, this data can be improved with statistical corrections or by applying a strong activity model. However, the corrections may only work for the set of conditions specified here. If other conditions are desired, then the corrections will not be valid.
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The OLI approach using full speciation is predictive over the entire range of OLI model conditions.
Figure 2.7
When all of the equilibria data is included (with aqueous reactions) in the calculations, the calculated partial pressure of the gases agrees with the experimental values shown in Figure 2.8. This is done without specialized data regression to the general range of this data. This provides confidence that the predictions will hold at other conditions.
Figure 2.8
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Speciation in Sour Water
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Aqueous Thermodynamics
3-1
3 Aqueous Thermodynamics
3.1 Thermodynamics Overview ............................................................ 2 3.2 Equilibrium Constant...................................................................... 2 3.3 Principal Thermodynamic Properties.............................................. 3 3.4 Helgeson-Kirkham-Flowers Equation of State ................................ 5 3.4.1 The Helgeson Equation of State.................................................. 7 3.5 Standard State ............................................................................... 9 3.5.1 3.5.2 3.5.3 3.5.4 Aqueous ................................................................................. 9 Vapour.................................................................................... 9 Organic Liquid ......................................................................... 9 Solid..................................................................................... 10
3.6 Excess Properties......................................................................... 10 3.6.1 Ionic Strength........................................................................ 11 3.6.2 Aqueous Activity Coefficients ................................................... 11 3.7 Multi-phase Model........................................................................ 17 3.7.1 Solid-Aqueous Equilibrium ....................................................... 18 3.7.2 Solid Phase Thermodynamic Properties ..................................... 18 3.7.3 Mixed EOS Model ................................................................... 19 3.8 Scaling Tendencies ...................................................................... 20
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Thermodynamics Overview
3.1 Thermodynamics Overview

Understanding aqueous thermodynamics is essential for the modeling of electrolytes. The Aspen HYSYS-OLI Interface package is based on the OLI thermodynamic framework, which is briefly discussed in Chapter 1 - Aspen HYSYS-OLI Interface. A thorough discussion of OLIs underlying aqueous thermodynamic framework is presented in this section. OLI provides a complete speciation model for prediction of thermophysical properties of aqueous-based systems over a broad range of operating conditions. This includes principle thermodynamic properties, equations of state, excess properties, modern models, multi-phase models, limitations to the current Aspen HYSYS-OLI Interface model, and scaling tendencies.
3.2 Equilibrium Constant

Refer to Section 3.5 Standard State for the definition of standard state.
The evaluation of the following standard state equation is central to OLI software.
(3.1)
R G = RT ln K where:
R G = partial molal, standard-state Gibbs Free Energy of reaction. The subscript R refers to an equilibrium reaction, not gas constant R = Gas Constant (8.314 J/mole/K) T = temperature (Kelvin) K = equilibrium constant
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The total free energy, R G , not just the standard state portion is defined as:
R G =
vi f Gi (Products) vi f Gi (Reactants)
i i
(3.2)
where: vi = stoichiometric coefficient f G i = Gibbs Free Energy of formation for a species i
3.3 Principal Thermodynamic Properties

Aqueous thermodynamic properties are also discussed in Section 1.3 - Gibbs Free Energy with focus on the aqueous phase. The following thermodynamic properties are composed of two parts: The standard state part that is only a function of temperature and pressure (denoted by the superscript ). The excess part that is a function of temperature, pressure, and concentration (denoted by the superscript E ).
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Principal Thermodynamic
Partial Molal Gibbs Free Energy

Gi = Gi + Gi
E
(3.3)
Partial Molal Enthalpy

Hi = Hi + Hi
E
(3.4)
Partial Molal Entropy

Si = Si + Si
E
(3.5)
Partial Molal Heat Capacity

Cp i = Cp i + Cp i
E
(3.6)
Partial Molal Volume

Vi = Vi + Vi where:
0 E
E
(3.7)
= standard state property = excess property
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3.4 Helgeson-KirkhamFlowers Equation of State

Helgeson, Kirkham, and Flowers (HKF)1,2 have found that the standard state thermodynamic property of any species in water can be represented by a function with seven terms which have specific values for each species. The seven terms (a1-4, c1-2, and ) are integration constants for volume (a), heat capacity (c), and temperature and pressure properties of water ( ). They are independent of the data system used to obtain them and are shown below.
H i = H i + f Hi (a1,...,a4,c1,c2, ) G i = G i + S i ( T T ) + f Gi (a1,...,a4,c1,c2, ) S i = S i + f Si (a1,...,a4,c1,c2, ) Cp i = Cp i + f Cpi (a1,...,a4,c1,c2, ) V i = V i + f Vi (a1,...,a4,c1,c2, ) where: R = the reference state property (25C, 1 bar) = standard state property a1....a4 = the pressure effects c1, c2 = the temperature effects
R R R R R R
(3.8)
1. H.C. Helgeson, D.H. Kirkham, G.C. Flowers. Theoretical Prediction of the Thermodynamic Behavior of Aqueous Electrolytes at High Pressures and Temperatures - Parts I through IV. American Journal of Science 1974, 1976, 1981. 2. J.C. Tanger, IV Doctoral Thesis. Calculation of the Standard Partial Molal Thermodynamic Properties of Aqueous Ions and Electrolytes at High Pressures and Temperatures" University of California at Berkeley, 1986 H.C. Helgeson Advisor. 3-5
3-6
Helgeson-Kirkham-Flowers
= pressure and temperature effects
The Helgeson equation of state parameters are used to predict equilibrium constants. The logarithm of the equilibrium constant (LOG K) for the dissociation of the bicarbonate ion as a function of temperature at saturation pressure is shown in the following figure.
Figure 3.1
The symbols represent the data taken from the reference footnotes1,2,3,4, 5, although the line was generated from the equation of state.
1. H.S. Harned and S.R. Scholes. The Ionization Constant of HCO3- from 0 to 50. Journal of the American Chemical Society 63, 1706 (1941). 2. R. Nasanen. Zur Einwirkung der Saure und Basenzusatze auf die Fallungskurvevon Bariumcarbonate. Soumen Kemistilehti 90, 24 (1946). 3. F. Cuta and F. Strafelda. The second dissociation constant of carbonic acid between 60 and 90C. Chem. Listy 48, 1308 (1954). 4. B.N. Ryzhenko. Geochemistry International 1, 8 (1963). 5. C.S. Patterson, G.H. Slocum, R.H. Busey, and R.E. Mesmer. Carbonate equilibrium in hydrothermal systems: First ionization of carbonic acid in NaCl media to 300C. Geoch. Cosmoh. Acta 46, 1653 (1982). 3-6
3-7
3.4.1 The Helgeson Equation of State

Enthalpy
1 --------------1 ------------ a H P, T = H f + c 1 ( T T r ) c 2 T T r + 1 ( P P r )
2T + P- + P --------------------------------------------------+ a 2 ln 2 + P r + a 3 ( P P r ) + a 4 ln + P r (T ) 1 1 1 - - 1 - 1 + TY T ------- Pr, Tr -------------+ -1 T P Pr, Tr Pr, Tr T r Y r
(3.9)
Gibbs Free Energy

T- ---G P, T = G f S Pr, Tr ( T T r ) c 1 T ln T r T + T r + a 1 ( P P r )
+P +P +P 1 + a 2 ln ---------------- ---------------- + a 3 ( P P r ) + a 4 ln ---------------- ----------- + P r + P r + P r T 1 T T T 1 1 r ( T ) - 1 - + -- ln ---------------------- c 2 ------------- --------------- ------------- -----2 T ( T ) T T r r 1 - ------------- Pr, Tr Pr, Tr + Pr, Tr Y Pr, Tr ( T T r )
(3.10)
Volume
1 ------------1 1 1 --------------- ------ -------------+ a3 + a4 V = a1 + a2 + P T Q + 1 P T + P
(3.11)
3-7
3-8
Helgeson-Kirkham-Flowers
Heat Capacity at Constant Pressure

1 2 +P 2 T - a ( P P r ) + a 4 In ---------------- Cp = c 1 + c 2 ------------- --------------------3 3 T + P r (T ) 2 ------ T 1 -- 1 -------+ TX + 2 TY T P 2 T P (3.12)
Entropy
T r ( T ) 1 T c 2 1 1 -- - ------------- --------------- + - ln ----------------------S = S Pr ,Tr + c 1 ln ---- --- T T r T ( T r ) Tt 1 2 +P + ------------- a 3 ( P P r ) + a 4 ln ---------------- + Y T + P r 1 -- ------ 1 T P Pr, Tr Y Pr, Tr where: H = enthalpy G = Gibbs free energy V = volume Cp = heat capacity at constant pressure S = entropy = 228 K Y = 2600 bar w = temperature and pressure dependent term for the electrostatic nature of electrolytes Q = pressure functions of the dielectric constant e = dielectric constant of water a1...a4 = pressure dependent terms c1, c2 = pressure dependent terms (3.13)
3-8
3-9
3.5 Standard State

The standard state refers to a thermodynamic value at a defined state (temperature, pressure, and concentration)1.
3.5.1 Aqueous
The hypothetical 1.0 molal solution extrapolated from infinite dilution.
Figure 3.2
3.5.2 Vapour
The Ideal Gas Pure Component (mole fraction = 1.0).
3.5.3 Organic Liquid

The Ideal Gas Pure Component (mole fraction = 1.0).
1. M. Rafal, J.W. Berthold, N.C. Scrivner, and S.L. Grise. Chapter 7: Models for Electrolyte Solutions, Models for Thermodynamic and Phase Equilibria Calculations. Stanley I Sandler, Ed. MarcelDekker, Inc. New York: 1994. p. 686. 3-9
3-10
Excess Properties
3.5.4 Solid
The pure component solid.
3.6 Excess Properties

Excess properties are a function of temperature, pressure and composition. With excess properties, the concept of activities and activity coefficients is introduced. The excess property which is most important is the excess Gibbs free energy. An introduction to molal properties can be referred to in Section 1.3 - Gibbs Free Energy.
G i = RT ln ai ai = i mi
(3.14)
This equation can be rewritten as:

E
G i = RT ln ai
(3.15)
Other excess properties involve various partial derivatives of i with respect to temperature and/or pressure:
E 2 ln i H i = RT -------------T
(3.16)
P
3-10
3-11
3.6.1 Ionic Strength

The ionic strength is defined by the following equation:
nI
1 I = -2
( zi mi )
i=1
(3.17)
where: nI = number of charged species zi = charge number of species mi = molality
3.6.2 Aqueous Activity Coefficients

The aqueous activity coefficient is represented by a long and short range definition as shown in the following equation.
log i = Long range + Short range (3.18)
Long Range Term

Highly dilute solutions (e.g., 0.01 m NaCl). The ions are separated sufficiently such that the only interactions are between the ions and the solvent.
z A ( T ) I ln i = ---------------------------------1+A B( T) I where: A = ion size parameter A(T), B(T) = Debye-Huckel parameters related to dielectric constant of water At 25C and 1 Atm1:
3-11
2
(3.19)
3-12
Excess Properties
A(T) = 0.5092 kg0.5/mole0.5 B(T) = 0.3283 kg0.5/mole-cm X 10-8
Short Range Term

Increased concentrations in solution. The ions start to interact with each other (oppositely charged species attract, like charged species repel) in addition to the interactions with the solvent.
n
( bij ( T, I ) mj )
j=1
(3.20)
where: n = number of oppositely charged species
Modern Formulations
Bromley-Meissner: Semi-Correlative
The Bromley1-Meissner2 equation can predict and extrapolate excess properties when data is limited or unavailable.
Bromley
A Z + Z - I ( 0.06 + 0.6 B ) Z + Z - I - + ------------------------------------------------------ + BI Log = --------------------------1.5 2 1+ I 1 + ------------------- Z + Z - I (3.21)
where: A = Debye-Huckel constant
1. H.C. Helgeson and D.H. Kirkham. American Journal of Science Vol. 274, 1199 (1974) 1. L.A. Bromley. Journal of Chemical Thermodynamics 4, 669 (1972) 2. H.P. Meissner. AIChE Symposium Ser. No. 173, 74, 124 (1978) 3-12
3-13
I = ionic strength B = Bromley parameter = mean activity coefficient Z+ = charge of cation Z- = charge of anion
Bromley-Zemaitis
Joseph Zemaitis extended the work of Bromley by adding two new terms to the Bromley-Zemaitis1 activity model.
A Z + Z - I ( 0.06 + 0.6 B ) Z + Z - I - + ------------------------------------------------------ + BI + CI 2 + DI 3 Log = --------------------------1.5 2 1+ I 1 + ------------------- Z Z I
+ -
(3.22)
Zemaitis added the C and D terms. Each of the B, C, and D terms have the following temperature (T in C) functionality.
2 2 2
B = B1 + B2 T + B3 T
C = C1 + C2 T + C3 T
(3.23)
D = D1 + D2 T + D3 T
1. Zemaitis, J.F., Jr., D.M. Clark, M. Rafal, and N.C. Scrivner, Handbook of Aqueous Electrolyte Thermodynamics, American Institute of Chemical Engineers, New York, 1986. 3-13
3-14
Excess Properties
Pitzer: Highly Interpolative

The Pitzer1 equation is somewhat dependent on the model. When using large amount of published data, considerable caution is required to verify the employed standard state model.
2 ( v + v - ) 2 ( v+ v- ) - B + m 2 ----------------------- C Log = Z + Z - f + m ---------------- v v
1.5
(3.24)
where: f = Debye-Huckel term2 v+ = stoichiometric coefficient for the cation v- = stoichiometric coefficient for the anion v = v+ + vm = concentration (molal) B = Pitzer B term that contains adjustable parameters C = Pitzer V term that contains adjustable parameters

1. K.S. Pitzer, et al. Journal of Soln. Chem 4, 249 (1975); Journal of Phys Chem. 81, 1872 (1977); Journal of Soln. Chem. 7, 327(1978); Journal of the American Chemical Society 96, 5701 (1974) 2. IBID, p 74 3-14
3-15
Helgeson: Limited in Scope

v i, k ------- b Y I v k il l v A Zi Zl I b Y I k l, k il i l - b k Y k I + --------------------------------- + ------- ----------------= ---------------------------- + + ---- vk l vk i 1 + a0 B I k i (3.25)
Log
where: A = Debye-Huckel constant according to Helgeson1 Zi = charge on cation Zl = charge on anion ao = ion size parameter B = extended Debye-Huckel term according to Helgeson I = true ionic strength which includes the effects of complexation = conversion of molal activity to mole fraction activity k = electrostatic effects on the solvent due to the species k k = moles of electrolyte (summation) i ,k = moles of cation per mole of electrolyte l ,k = moles of anion per mole of electrolyte bi,l = adjustable parameter for the ion-ion interaction Yi = fraction of ionic strength on a true basis attributed to the cation Yl = fraction of ionic strength on a true basis attributed to the anion i = (half) the cation charge l = (half) the anion charge
Neutral Species
Neutral molecules in water are affected by other species in a solution. The salting in and out of a gas is a typical example.
1. H.C. Helgeson, D.H. Kirkham, and G.C. Flowers. American Journal of Science. 281, 1249 (1981) 3-15
3-16
Excess Properties
When oxygen is dissolved in pure water, it has a typical solubility. When salt is added, the oxygen solubility decreases. This is most likely due to interactions of sodium and chloride ions reacting with the neutral oxygen molecule.
3-16
3-17
The solubility of oxygen in NaCl solutions at 25C and 1 atm is shown in the figure below.
Figure 3.3
Setschenow
This phenomenon known as salting in/out is characterized by the Setschenow1 equation. The formulation is in terms of the ratio of solubilities in pure water to an aqueous salt solution at a constant temperature.
So - = Km s Ln aq = ---Ss where: So = solubility of gas in pure water Ss = solubility of gas in a salt solution K = Setschenow coefficient ms = concentration of the salt
(3.26)
In this case, the K is approximately equal to -0.0002. It should be noted that this approach is limited to a single temperature.
1. J. Setschenow, Z. Physik. Chem., 4, 117 (1889) 3-17
3-18
Multi-phase Model
Pitzer
The Pitzer1 formulation is a more rigorous approach than the Setschenow equation. The effects of temperature and composition can be modeled.
Ln aq = 2 0 ( m m ) m m + 2 0 ( m s ) m s where: 0 ( m m ) = adjustable parameter for molecule-molecule interactions. (A function of temperature) 0 ( m s ) = adjustable parameter for molecule-ion interactions. (A function of temperature) ms = concentration of neutral species (3.27)
3.7 Multi-phase Model

The thermodynamic multiple physical phases in equilibrium with the aqueous phase are discussed in this section. The model will correctly predict precipitating solids, formation of a gas phase and a second (non-aqueous) liquid phase. Refer to Section 1.5 - Other Physical Phases in Equilibrium for more information on physical phases in equilibrium with the aqueous phase.
1. K.S. Pitzer, et al. Journal of Soln. Chem 4, 249 (1975); Journal of Phys. Chem. 81, 1872 (1977); Journal of Soln. Chem. 7, 327 (1978); Journal of Am. Chem. Soc. 96, 5701 (1974) 3-18
3-19
3.7.1 Solid-Aqueous Equilibrium

The general solid-aqueous equilibrium form is characterized below.
Si = p1 P1 + p2 P2 + + pp Pp (3.28)
Examples of solid-aqueous reactions include:

NaCl ( cr ) = Na ( aq ) + Cl CaSO 4 2 H 2 O = Ca
2+ ( aq ) + aq ) 2-
+ SO 4 ( aq ) + 2 H 2 O
3.7.2 Solid Phase Thermodynamic Properties

Solids in equilibrium with the aqueous phase are independent phases. Thus, the Gibbs free energy is calculated for individual solids and is represented by the classical thermodynamic equation.
T T P
G Si = G Si + S Si ( T T ) +
Cp ------ dT dT + T
R
V dP
P
R
T T
Cp = a 1 + a 2 T + a 3 T V = b1
(3.29)
B 2 - + CT K + DT K + E + FP + GP2 Log 10 K sp ( T, P ) = A + ----TK
The compressibility of the solid remains constant (V = b1) when simulated under normal conditions.
3-19
3-20
Multi-phase Model
3.7.3 Mixed EOS Model

In addition to solids, Aspen HYSYS-OLI Interface accounts for the possible formation of a gas and a second (non-aqueous) phase. The following thermodynamic equations are applied to the gas and liquid phases based on the enhanced SRK formulation.
Vapour-Aqueous Phase
The gas or vapour-aqueous phase is represented by the general thermodynamic equation.
G Vi = G Aqi G Vi + RT ln ( Vi y i P ) = G Aqi + RT ln ( i m i ) a Aqi = i m i f vi = Vi y i P The reference state for the vapor is the ideal gas G Vi + RT ln ( f Vi ) = G Aqi + RT ln ( a Aqi ) a Aqi G Aqi G Vi K = EXP -------------------------- = --------RT f Vi
o o o o o o
(3.30)
3-20
3-21
Non-Aqueous Liquid-Aqueous Phase

The non-aqueous second liquid phase is represented by the following thermodynamic equation.
G Li = G Aqi The reference state for the non-aqueous liquid is the ideal gas vapor G Vi + RT ln ( Li y i P ) = G Aqi + RT ln ( i m i ) a Aqi = i m i f Li = Li y i P G Vi + RT ln ( f Li ) = G Aqi + RT ln ( a Aqi ) a Aqi G Aqi G Li - = --------K = EXP ------------------------RT f Li
o o o o o o
(3.31)
3.8 Scaling Tendencies

The scaling tendency is the ratio of the real-solution solubility product to the thermodynamic limit based on the thermodynamic equilibrium constant. For Example, consider the following dissolution:
NaHCO 3 ( s ) = Na + HCO 3
+ -
The ion activity product (IAP) is defined as the product of specific ions. In this case that would be the ions that result from the dissociation of a particular solid. For this example, a 1.0 molal NaHCO3 solution is considered.
IAP = Na m Na HCO m HCO
3 3
3-21
3-22
Scaling Tendencies
Assuming Ideal solution activities:

Na = 1.0 m Na = 1.0 HCO = 1.0
3
m HCO = 1.0
3
IAP = (1.0)(1.0)(1.0)(1.0) = 1.0
The solubility product (Ksp) is the thermodynamic limit of ion availability.

K sp = [ Na ] [ HCO ] K sp = 0.403780
+ - 3
The scaling tendency (ST) is then the ratio of available ions to the thermodynamic limit.
IAP ST = --------K sp 1.0 ST = --------------------= 2.48 0.403780
The above scaling factor is based on assuming ideal conditions. The actual species concentration and activity coefficients are:
IAP = (0.598)(0.894)(0.596)(0.866) = 0.276 Na = 0.598 m Na = 0.894 HCO = 0.596
3
m HCO = 0.866
3
Therefore, the new scaling tendency is:

IAP ST = --------K sp 0.276 ST = --------------------= 0.683 0.403780
The concentrations are not equal to 1.0. This is due to speciation and the chemical equilibria which tend to form complexes that provide a sink for carbonate species. For this example, the concentrations (molal) are:
CO 2 = 0.016 CO 3
2o
NaHCO 3 = 0.101 NaCO 3 = 0.004

-
= 0.012
3-22
3-23
The scaling tendencies represent the following: If ST < If ST > If ST = Scaling 1, then the solid is under-saturated 1, then the solid is super-saturated 1, then the solid is at saturation Index = Log (ST)
TRANGE
TRANGE is the nomenclature for solids that have been fit to a polynomial form rather than pure thermodynamics. The polynomial has the following functional form:
2
Log K = A + B/T + CT + DT
(3.32)
It is known that extrapolating polynomials is inaccurate and may lead to incorrect predictions of the scaling tendency. Therefore, the applicable range is generally limited to data set. Consider the following example for a four solid system.
Solid Na2CO310H2O Na2CO37H2O Na2CO31H2O Na2CO3 Temperature Range (C) 0 - 35 35 - 37 37 - 109 109 - 350
The table above indicates that the solids change their form as the temperature is increased. Each solid is fit to the above polynomial. There may be problems if the extrapolated values from higher number hydrates extend to the regions where the lower number hydrates are stable.
3-23
3-24
Scaling Tendencies
Notice that the deca-hydrate species does not extrapolate smoothly to high temperatures as shown below.
Figure 3.4
At 350 K, it can be seen that if the solid is included in the model, the equilibrium based solver would attempt to include it over the actual solid, which is the monohydrate. Since the decahydrate species is outside the temperature range, it is mathematically eliminated from the equations.
3-24
Aspen HYSYS-OLI Interface Full Database A-1
Aspen HYSYS-OLI Interface Full Database

A.1 List of Full Aspen HYSYS-OLI Interface Database .......................... 2
A-1
A-2
List of Full Aspen HYSYS-OLI
A.1 List of Full Aspen HYSYS-OLI Interface Database

Currently, Aspen HYSYS only supplies the Aspen HYSYS-OLI Interface Name column for component databases.
The full database covers thousands of species in water. In terms of inorganic chemistry this includes much of the aqueous chemistry including speciation reactions for 79 elements in water from the Periodic Table. In addition, thousands of organic chemical compounds (electrolyte and non-electrolyte) are covered. The following list includes the Aspen HYSYS-OLI Interface Name, Formula and the Common/IUPAC name. To find or match an electrolyte component in Aspen HYSYS, select the appropriate component or type in the Aspen HYSYS-OLI Interface name.
Aspen HYSYSOLI Interface Name ET4NION ET4NBR ET4NCL ET4NCLO4 ET4NI PR4NION PR4NBR PR4NCL PR4NI TRIBUTPHOS BU4NION BU4NBR BU4NCL BU4NI AM4NION AM4NBR AM4NCL AM4NI HX4NION HX4NBR
Formula (C2H5)4N+1 (C2H5)4NBr (C2H5)4NCl (C2H5)4NClO4 (C2H5)4NI (C3H7)4N+1 (C3H7)4NBr (C3H7)4NCl (C3H7)4NI (C4H9)3PO4 (C4H9)4N+1 (C4H9)4NBr (C4H9)4NCl (C4H9)4NI (C5H11)4N+1 (C5H11)4NBr (C5H11)4NCl (C5H11)4NI (C6H13)4N+1 (C6H13)4NBr
Common/IUPAC Name Tetraethylammonium ion(+1) Tetraethylammonium bromide Tetraethylammonium chloride Tetraethylammonium perchlorate Tetraethylammonium iodide Tetrapropylammonium ion(+1) Tetrapropylammonium bromide Tetrapropylammonium chloride Tetrapropylammonium iodide Tri-n-butylphosphate Tetrabutylammonium ion(+1) Tetrabutylammonium bromide Tetrabutylammonium chloride Tetrabutylammonium iodide Tetraamylammonium ion Tetrapentylammonium bromide Tetrapentylammonium chloride Tetrapentylammonium iodide Tetrahexylammonium ion(+1) Tetrahexylammonium bromide
A-2
Formula (C6H13)4NCl (C6H13)4NI (CaHCO3)2CO3 (CaHCO3)2SO4 (CH3)4N+1 (CH3)4NBr (CH3)4NCl (CH3)4NClO4 (CH3)4NF (CH3)4NI (CH3)4NNO3 (COOH)2.2H2O (HF)2 (HF)6 (MgCl)2CO3 (MgCl)2SO4 (MgHCO3)2CO3 (MgHCO3)2SO4 (NH4)2C2O4 (NH4)2C2O4.1H2O (NH4)2CO3 (NH4)2CO3.2NH4HCO3 (NH4)2HPO4 (NH4)2HPO4.2H2O (NH4)2S (NH4)2S5 (NH4)2SiF6 (NH4)2SO3 (NH4)2SO3.1H2O (NH4)2SO4 (NH4)3PO4 (NH4)3PO4.3H2O (NpO2)2(OH)2+2 (NpO2)2C2O4 (NpO2)3(OH)5+1 (P2O5)2
Common/IUPAC Name Tetrahexylammonium chloride Tetrahexylammonium iodide Di(calcium bicarbonate) carbonate Di(calcium bicarbonate) sulfate Tetramethylammonium ion(+1) Tetramethylammonium bromide Tetramethylammonium chloride Tetramethylammonium perchlorate Tetramethylammonium fluoride Tetramethylammonium iodide Tetramethylammonium nitrate Oxalic acid dihydrate Hydrofluoride, dimer Hydrogen fluoride, hexamer Di(magnesium chloride) carbonate Di(magnesium chloride) sulfate Di(magnesium bicarbonate) carbonate Di(magnesium bicarbonate) sulfate(VI) Ammonium oxalate Ammonium oxalate monohydrate Ammonium carbonate Ammonium sesquicarbonate Ammonium hydrogen orthophosphate Ammonium hydrogen orthophosphate dihydrate Ammonium sulfide Ammonium pentasulfide Ammonium hexafluorosilicate Ammonium sulfite Ammonium sulfite monohydrate Ammonium sulfate Ammonium orthophosphate Ammonium phosphate trihydrate Di(dioxoneptunium(VI)) dihydroxide ion(+2) Dioxoneptunium(V) oxalate Tri(dioxoneptunium(VI)) pentahydroxide ion(+1) Phosphorus pentoxide
Aspen HYSYSOLI Interface Name HX4NCL HX4NI CAHCO32CO3 CAHCO32SO4 ME4NION ME4NBR ME4NCL ME4NCLO4 ME4NF ME4NI ME4NNO3 OXALAC.2H2O H2F2 H6F6 MGCL2CO3 MGCL2SO4 MGHCO32CO3 MGHCO32SO4 NH42OX NH42OX.1H2O NH42CO3 NH44H2CO33 NH42HPO4 NH42HPO4.2H2O NH42S NH42S5 NH42SIF6 NH42SO3 NH42SO3.1H2O NH42SO4 NH43PO4 NH43PO4.3H2O NPO22OH2ION NPVO22C2O4 NPO23OH5ION P4O10
A-3
A-4
Formula (PuO2)2(OH)2+2 (PuO2)2C2O4 (PuO2)3(OH)5+1 (TcO(OH)2)2 (UO2)(ASO4)2 (UO2)2(OH)2+2 (UO2)2[C10H12N2O8] (UO2)2[C6H5O7]2-2 (UO2)2Cl3 (UO2)2P2O7 (UO2)3(OH)5+1 (UO2)3(PO4)2 (UO2)3(PO4)2.4H2O [Pt(NH3)6](OH)4 [Pt(NH3)6]Cl4 2Na2SO4.Na2CO3 Ag Ag(C2O4)-1 Ag(CN)2-1 Ag(CN)3-2 Ag(NH3)2+1 Ag(NO2)2-1 Ag(OH)2-1 Ag(SCN)2-1 Ag(SCN)3-2 Ag(SCN)4-3 Ag[C10H12N2O8]-3 Ag[C14H18N3O10]-4 Ag[C2H3O2] Ag[C2H3O2]2-1 Ag[C2H3O3] Ag[C2H3O3]2-1 Ag[C2H7NO]+1 Ag[C2H7NO]2+1 Ag[C2H8N2]+1 Ag[C2H8N2]2+1
Common/IUPAC Name Di(dioxyplutonium(VI)) dihydroxide ion(+2) Di(dioxyplutonium(V)) oxalate Tri(dioxyplutonium(VI)) pentahydroxide ion(+1) Oxytechnetium(IV) dihydroxide, dimer Uranyl(VI) arsenate Diuranyl(VI) dihydroxide ion(+2) Diuranyl(VI) EDTA Diuranyl(VI) ditartrate ion(-2) Uranyl(VI) uranyl(V) chloride Uranyl(VI) pyrophosphate Triuranyl(VI) pentahydroxide ion(+1) Uranyl(VI) orthophosphate Uranyl(VI) orthophosphate tetrahydrate Platinum(IV) hexaammonia tetrahydroxide Platinum(IV) hexaammonia tetrachloride Hexasodium carbonate bissulfate Silver Silver oxalate ion(-1) Silver dicyanide ion(-1) Silver tricyanide ion(-2) Silver diammonia ion(+1) Silver dinitrite ion(-1) Silver dihydroxide ion(-1) Silver dithiocyanate ion(-1) Silver trithiocyanate ion(-2) Silver tetrathiocyanate ion(-3) Silver EDTA ion(-3) Silver DTPA ion(-4) Silver(I) acetate Silver diacetate ion(-1) Silver glycolate Silver diglycolate ion(-1) Silver mono(2-aminoethanol) ion(+1) Silver di(2-aminoethanol) ion(+1) Silver monoethylenediamine ion(+1) Silver diethylenediamine ion(+1)
Aspen HYSYSOLI Interface Name PUO22OH2ION PUVO22C2O4 PUO23OH5ION TCIVOOH22 UO23ASO42 UO22OH2ION UO22EDTA UO22CTRT2ION UO22CL3 UO22P2O7 UO23OH5ION UO23PO42 UO23PO42.4H2O PTIVNH36OH4 PTNH36CL4 NA6SO42CO3 AGEL AGC2O4ION AGCN2ION AGCN3ION AGNH32ION AGNO22ION AGOH2ION AGSCN2ION AGSCN3ION AGSCN4ION AGEDTAION AGDTPAION AGACET AGACET2ION AGGLYCOL AGGLYCOL2ION AGMEXHION AGMEXH2ION AGEDAION AGEDA2ION
A-4
Formula Ag[C4H11NO2]+1 Ag[C4H11NO2]2+1 Ag[C6H15NO3]+1 Ag[C6H15NO3]2+1 Ag[C6H6NO6]-2 Ag[H2C6H6NO6] Ag[H3C10H12N2O8] Ag[H4C14H22N3O10] Ag[HC10H13N2O8]-2 Ag[HC2H8N2]+2 Ag+1 Ag2[C2H8N2]2+2 Ag2C2O4 Ag2CO3 Ag2MoO4 Ag2O Ag2S Ag2Se Ag2SeO3 Ag2SeO4 Ag2SO4 Ag2WO4 Ag3AsO4 Ag3PO4 AgBr AgBr2-1 AgBr3-2 AgBr4-3 AgCl AgCl2-1 AgCl3-2 AgCl4-3 AgCN AgF AgF.2H2O AgF.4H2O AgI AgI2-1
Common/IUPAC Name Silver mono(N,N-diethanolamine) ion(+1) Silver di(N,N-diethanolamine) ion(+1) Silver monotriethanolamine ion(+1) Silver di(triethanolamine) ion(+1) Silver NTA ion(-2) Silver dihydrogen NTA Silver trihydrogen EDTA Silver tetrahydrogen DTPA Silver hydrogen EDTA ion(-2) Silver hydrogen ethylenediamine ion(+2) Silver ion(+1) Disilver diethylenediamine ion(+2) Silver(I) oxalate Silver(I) carbonate Disilver molybdenum tetraoxide Silver(I) oxide Silver(I) sulfide Silver(I) selenide Disilver selenium trioxide Disilver selenium tetraoxide Silver(I) sulfate Disilver tungsten tetraoxide Trisilver arsenium tetraoxide Silver(I) phosphate Silver(I) bromide Silver dibromide ion(-1) Silver tribromide ion(-2) Silver tetrabromide ion(-3) Silver chloride Silver dichloride ion(-1) Silver trichloride ion(-2) Silver tetrachloride ion(-3) Silver cyanide Silver(I) fluoride Silver(I) fluoride dihydrate Silver(I) fluoride tetrahydrate Silver iodide Silver diiodide ion(-1)
Aspen HYSYSOLI Interface Name AGDEXHION AGDEXH2ION AGTEXHION AGTEXH2ION AGNTAION AGH2NTA AGH3EDTA AGH4DTPA AGHEDTAION AGHEDAION AGION AG2EDA2ION AG2C2O4 AG2CO3 AG2MOO4 AG2O AG2S AG2SE AG2SEO3 AG2SEO4 AG2SO4 AG2WO4 AG3ASO4 AG3PO4 AGBR AGBR2ION AGBR3ION AGBR4ION AGCL AGCL2ION AGCL3ION AGCL4ION AGCN AGF AGF.2H2O AGF.4H2O AGI AGI2ION A-5
A-6
Formula AgI3-2 AgI4-3 AgNO2 AgNO3 AgOH AgSCN AgSO4-1 Al Al(NO2)3 Al(NO3)3 AL(NO3)3.6H2O Al(NO3)3.8H2O Al(NO3)3.9H2O Al(OH)2+1 Al(OH)3 Al(OH)4-1 Al(SO4)2-1 Al[C10H12N2O8]-1 Al[C14H18N3O10]-2 Al[C2H3O2]+2 Al[C2H3O2]2+1 Al[C2H3O2]3 Al[H2C14H18N3O10] Al[HC10H12N2O8] Al[HC14H18N3O10]-1 Al+3 Al2(SO4)3 Al2(SO4)3.16H2O Al2(SO4)3.6H2O Al2Mn3O12Si3 Al2S3 Al2Si2O5(OH)4 Al2SiO5(OH)4 Al4Fe5Si6O22(OH)2 AlBr3 AlCl3
Common/IUPAC Name Silver triiodide ion(-2) Silver tetraiodide ion(-3) Silver nitrite Silver nitrate Silver hydroxide Silver thiocyanate Silver sulfate ion(-1) Aluminum Aluminum nitrite Aluminum nitrate Aluminum nitrate hexahydrate Aluminum nitrate octahydrate Aluminum nitrate nonahydrate Aluminum dihydroxide ion(+1) Aluminum hydroxide Aluminum tetrahydroxide ion(-1) Aluminum disulfate ion(-1) Aluminum EDTA ion(-1) Aluminum DTPA ion(-2) Aluminum monoacetate ion(+2) Aluminum diacetate ion(+1) Aluminum acetate Aluminum dihydrogen DTPA Aluminum hydrogen EDTA Aluminum hydrogen DTPA ion(-1) Aluminum ion(+3) Aluminum sulfate Aluminum sulfate hexadecahydrate Aluminum sulfate hexahydrate Dialuminum trimanganese trisilicon dodecaoxide Aluminum sulfide Halloysite Dialuminum silicon pentaoxide tetrahydroxide Tetraaluminum pentairon hexasilicon docosaoxide dihydroxide Aluminum bromide Aluminum chloride
Aspen HYSYSOLI Interface Name AGI3ION AGI4ION AGNO2 AGNO3 AGOH AGSCN AGSO4ION ALEL ALNO23 ALNO33 ALNO33.6H2O ALNO33.8H2O ALNO33.9H2O ALOH2ION ALOH3 ALOH4ION ALSO42ION ALEDTAION ALDTPAION ALACETION ALACET2ION ALACET3 ALH2DTPA ALHEDTA ALHDTPAION ALION AL2SO43 AL2SO43.16H2O AL2SO43.6H2O MN3AL2SI3O AL2S3 HALLOYSITE DICKITE FERROGDRIT ALBR3 ALCL3
A-6
Formula AlCl3.6H2O AlF+2 AlF2+1 AlF3 AlF3.3H2O AlF4-1 AlF5-2 AlF6-3 AlI3 AlO(OH) AlOH+2 AlPO4 AlSO4+1 Am(C2O4)2-1 Am(C2O4)3-3 Am(CO3)2-1 Am(HCO3)2+1 Am(NO3)2+1 Am(NO3)3 Am(OH)2+1 Am(OH)3 Am(OH)4 Am(SO4)2-1 Am[C10H12N2O8]-1 Am[C10H13N2O8] Am[C14H18N3O10]-2 Am[C2H3O3]+2 Am[C2H3O3]2+1 Am[C2H3O3]3 Am[C6H5O7] Am[C6H5O7]2-3 Am[C6H6NO6] Am[C6H6NO6]2-3 Am[H2C14H18N3O10] Am[HC10H12N2O8] Am+3 Am+4 Am2(C2O4)3
Common/IUPAC Name Aluminum chloride hexahydrate Aluminum monofluoride ion(+2) Aluminum difluoride ion(+1) Aluminum fluoride Aluminum fluoride trihydrate Aluminum tetrafluoride ion(-1) Aluminum pentafluoride ion(-2) Aluminum hexafluoride ion(-3) Aluminum iodide Aluminum oxide hydroxide Aluminum monohydroxide ion(+2) Aluminum phosphate Aluminum monosulfate ion(+1) Americium(III) dioxalate ion(-1) Americium(III) trioxalate ion(-3) Americium(III) dicarbonate ion(-1) Americium(III) di(bicarbonate) ion(+1) Americium(III) dinitrate ion(+1) Americium(III) nitrate Americium(III) dihydroxide ion(+1) Americium(III) hydroxide Americium(IV) hydroxide Americium(III) disulfate ion(-1) Americium(III) EDTA ion(-1) Americium(III) hydrogen EDTA Americium(III) DTPA ion(-2) Americium(III) monoglycolate ion(+2) Americium(III) diglycolate ion(+1) Americium(III) glycolate Americium(III) citrate Americium(III) dicitrate ion(-3) Americium(III) NTA Americium(III) di-NTA ion(-3) Americium(III) dihydrogen DTPA Americium(III) hydrogen EDTA Americium(III) ion(+3) Americium ion(+4) Americium(III) oxalate
Aspen HYSYSOLI Interface Name ALCL3.6H2O ALFION ALF2ION ALF3 ALF3.3H2O ALF4ION ALF5ION ALF6ION ALI3 ALOOH ALOHION ALPO4 ALSO4ION AMIIIC2O42ION AMIIIC2O43ION AMCO32ION AMHCO32ION AMNO32ION AMNO33 AMIIIOH2ION AMIIIOH3 AMIVOH4 AMIIISO42ION AMEDTAION AMIIIHEDTA AMDTPAION AMIIIGLYCOION AMIIIGLYCO2ION AMIIIGLYCO3 AMCTRT AMCTRT2ION AMNTA AMNTA2ION AMH2DTPA AMHEDTA AMIIIION AMIVION AMIII2C2O43
A-7
A-8
Formula Am2(CO3)3 AmBr3 AmC2O4+1 AmCl+2 AmCl2+1 AmCl3 AmCO3+1 AmF+2 AmF2+1 AmF3 AmF4 AmHCO3+2 AmI3 AmNO3+2 AmO2(OH)2 AmO2+1 AmO2+2 AmO2OH AmOH+2 AmSO4+1 Ar As As(OH)2Cl3 As2O3 As2O5 As2O5.1.7H2O As2O5.4H2O As2S3 As2S4-2 As2S5 AsO+1 AsO2-1 AsO3-3 AsO4-3 Au Au(CN)2-1 Au(OH)3 Au(OH)3
Common/IUPAC Name Americium(III) carbonate Americium(III) bromide Americium(III) monooxalate ion(+1) Americium(III) monochloride ion(+2) Americium(III) dichloride ion(+1) Americium(III) chloride Americium(III) monocarbonate ion(+1) Americium(III) monofluoride ion(+2) Americium(III) difluoride ion(+1) Americium(III) fluoride Americium(IV) fluoride Americium(III) bicarbonate ion(+2) Americium(III) iodide Americium(III) mononitrate ion(+2) Americium dioxide dihydroxide Dioxyamericium(V) ion(+1) Dioxyamericium(III) ion(+2) Americium dioxide hydroxide Americium(III) monohydroxide ion(2) Americium(III) monosulfate ion(+1) Argon Arsenic Arsenic dihydroxide trichloride Arsenic(III) oxide Arsenic(V) oxide Arsenic(V) oxide 1.7-hydroxide Arsenic(V) oxide tetrahydrate Arsenic(III) sulfide Diarsenic(III) tetrasulfide ion(-2) Arsenic(V) sulfide Arsenic(III) monoxide ion(+1) Arsenic(III) dioxide ion(-1) Arsenic(III) trioxide ion(-3) Arsenic(III) tetraoxide ion(-3) Gold Gold(I) dicyanide ion(-1) Gold(III) hydroxide Gold(III) hydroxide
Aspen HYSYSOLI Interface Name AM2CO33 AMIIIBR3 AMIIIC2O4ION AMIIICLION AMIIICL2ION AMIIICL3 AMCO3ION AMIIIFION AMIIIF2ION AMIIIF3 AMIVF4 AMHCO3ION AMIIII3 AMNO3ION AMO2OH2 AMVO2ION AMO2ION AMVO2OH AMIIIOHION AMIIISO4ION AR ARSEL ASOH2CL3 AS2O3 AS2O5 AS2O5.1.7H2O AS2O5.4H2O AS2S3 AS2S4ION AS2S5 ARSOION ARSO2ION ARSO3ION ARSO4ION AUEL GLDICN2ION GLDIIIOH3 GOLDOH3
A-8
Formula Au(OH)4-1 Au(OH)5-2 Au+1 Au+3 AuBr AuBr2-1 AuBr3 AuBr4-1 AuCl AuCl3 AuCl4-1 AuCN AuI AuOH B B(C6H5)4-1 B(OH)3 B(OH)4-1 B2O6H5-1 B2S3 B3O3(OH)4-1 B4O5(OH)4-2 Ba Ba(CN)2 Ba(CN)2.1H2O Ba(CN)2.2H2O Ba(H2PO4)2 Ba(HCO3)(OH) Ba(HCO3)2 Ba(HS)2 Ba(HSO3)2 Ba(HSO4)2 Ba(NO2)2 Ba(NO2)2.1H2O Ba(NO3)2 Ba(OH)2 Ba(OH)2.8H2O Ba[C10H12N2O8]-2
Common/IUPAC Name Gold(III) tetrahydroxide ion(-1) Gold(III) pentahydroxide ion(-2) Gold ion(+1) Gold ion(+3) Gold(I) bromide Gold(I) dibromide ion(-1) Gold(III) bromide Gold(III) tetrabromide ion(-1) Gold(I) chloride Gold(III) chloride Gold(III) tetrachloride ion(-1) Gold(I) cyanide Gold(I) iodide Gold(I) hydroxide Boron Tetraphenyl borate ion(-1) Boric acid Boron tetrahydroxide ion(-1) Diboron oxide pentahydroxide ion(-1) Diboron trisulfide Triboron trioxide tetrahydroxide ion(-1) Tetraboron pentaoxide tetrahydroxide ion(-2) Barium Barium cyanide Barium cyanide monohydrate Barium cyanide dihydate Barium dihydrogen orthophosphate Barium hydroxide bicarbonate Barium bicarbonate Barium bisulfide Barium bisulfite Barium bisulfate Barium nitrite Barium nitrite monohydrate Barium nitrate Barium hydroxide Barium hydroxide octahydrate Barium EDTA ion(-2)
Aspen HYSYSOLI Interface Name GLDIIIOH4ION GLDIIIOH5ION GLDIION GLDIIIION GLDIBR GLDIBR2ION GLDIIIBR3 GLDIIIBR4ION GLDICL GLDIIICL3 GLDIIICL4ION GLDICN GLDIIOD GLDIOH BEL BPH4ION BOH3 BOH4ION B2OOH5ION B2S3 B3O3OH4ION B4O5OH4ION BAEL BACN2 BACN2.1H2O BACN2.2H2O BAH2PO42 BAOHHCO3 BAHCO32 BAHS2 BAHSO32 BAHSO42 BANO22 BANO22.1H2O BANO32 BAOH2 BAOH2.8H2O BAEDTAION A-9
A-10
Formula Ba[C10H14N2O8] Ba[C14H18N3O10]-3 Ba[C2H3O2]+1 Ba[C2H3O2]2 Ba[C2H3O2]2.2H2O Ba[C2H3O2]2.3H2O Ba[C2H3O3]+1 Ba[C2H3O3]2 Ba[C2H4NO2]+1 Ba[C2H4NO2]2 Ba[C3H6NO2]+1 Ba[C3H6NO2]2 Ba[C4H4O6] Ba[C6H5O7]-1 Ba[C6H6NO6]-1 Ba[H2C6H5O7]+1 Ba[H3C14H18N3O10] Ba[HC10H12N2O8]-1 Ba[HC14H18N3O10]-2 Ba[HC4H4O6]+1 Ba[HC6H5O7] Ba[HC6H6NO6] Ba[HCOO]+1 Ba[HCOO]2 Ba[NH2(COO)]2 Ba+2 Ba3(PO4)2 BaBr2 BaBr2.1H2O BaBr2.2H2O BaC2O4 BaC2O4.0.5H2O BaC2O4.2H2O BaC2O4.3.5H2O BaCl2 BaCl2.1H2O BaCl2.2H2O BaClOH
Common/IUPAC Name Barium dihydrogen EDTA Barium DTPA ion(-3) Barium monoacetate ion(+1) Barium acetate Barium acetate dihydrate Barium acetate trihydrate Barium monoglycolate ion(+1) Barium glycolate Barium monoglycine ion(+1) Barium diglycine Barium mono-(L-alpha-alanine) ion(+1) Barium di-(L-alpha-alanine) Barium tartrate Barium citrate ion(+1) Barium NTA ion(-1) Barium dihydrogen citrate ion(+1) Barium trihydrogen DTPA Barium hydrogen EDTA ion(-1) Barium hydrogen DTPA ion(-2) Barium hydrogen tartrate ion(+1) Barium hydrogen citrate Barium hydrogen NTA Barium monoformate ion(+1) Barium formate Barium dicarbamate Barium ion(+2) Barium phosphate(V) Barium bromide Barium bromide monohydrate Barium bromide dihydrate Barium oxalate Barium oxalate hemihydrate Barium oxalate dihydrate Barium oxalate 3.5 hydrate Barium chloride Barium chloride monohydrate Barium chloride dihydrate Barium hydroxide chloride
Aspen HYSYSOLI Interface Name BAH2EDTA BADTPAION BAACETION BAAC2 BAAC2.2H2O BAAC2.3H2O BAGLYCOLION BAGLYCOL2 BAGLYCINION BAGLYCIN2 BAALANION BAALAN2 BATARTRT BACTRTION BANTAION BAH2CTRTION BAH3DTPA BAHEDTAION BAHDTPAION BAHTARTRTION BAHCTRT BAHNTA BACOOHION BACOOH2 BANH2CO22 BAION BA3PO42 BABR2 BABR2.1H2O BABR2.2H2O BAOX BAOX.0.5H2O BAOX.2H2O BAOX.3.5H2O BACL2 BACL2.1H2O BACL2.2H2O BAOHCL
A-10
Aspen HYSYS-OLI Interface Full Database A-
Formula BaCO3 BaCrO4 BaF+1 BaF2 BaHCO3+1 BaHPO4 BaI2 BaI2.1H2O BaI2.2H2O BaI2.7.5H2O BaMoO4 BaOH+1 BaS BaSe BaSeO4 BaSO3 BaSO4 BaWO4 Be Be(OH)2 Be+2 BeO2-2 Bi Bi(NO3)2+1 Bi(NO3)3 Bi(OH)2+1 Bi(OH)3 Bi(OH)4-1 Bi[C10H12N2O8]-1 Bi[C2H3O2]+2 Bi[C2H3O2]2+1 Bi[C2H3O2]3 Bi[HC10H12N2O8] Bi+3 Bi2(SO4)3 Bi2S3 Bi2Se3 BiBr+2
Common/IUPAC Name Barium carbonate Barium chromate(VI) Barium monofluoride ion(+1) Barium fluoride Barium bicarbonate ion(+1) Barium hydrogen orthophosphate Barium iodide Barium iodide monohydrate Barium iodide dihydrate Barium iodide 7.5 hydrate Barium molybdate(VI) Barium hydroxide ion(+1) Barium sulfide Barium selenide Barium selenate Barium sulfite Barium sulfate Barium tungstate(VI) Beryllium Berrylium hydroxide Beryllium ion (+2) Beryllate ion (-2) Bismuth Bismuth(III) dinitrate ion(+1) Bismuth(III) nitrate Bismuth(III) dihydroxide ion(+1) Bismuth(III) hydroxide Bismuth(III) tetrahydroxide ion(-1) Bismuth(III) EDTA ion(-1) Bismuth(III) monoacetate ion(+2) Bismuth(III) diacetate ion(+1) Bismuth(III) triacetate Bismuth(III) hydrogen EDTA Bismuth ion(+3) Bismuth(III) sulfate Bismuth(III) sulfide Bismuth(III) selenide Bismuth(III) monobromide ion(+2)
Aspen HYSYSOLI Interface Name BACO3 BACRO4 BAFION BAF2 BAHCO3ION BAHPO4 BAI2 BAI2.1H2O BAI2.2H2O BAI2.7.5H2O BAMOO4 BAOHION BAS BASE BASEO4 BASO3 BASO4 BAWO4 BEEL BEOH2 BEION BEO2ION BIEL BINO32ION BINO33 BIOH2ION BIOH3 BIOH4ION BIEDTAION BIACETION BIACET2ION BIACET3 BIHEDTA BIION BI2SO43 BI2S3 BI2SE3 BIBRION
A-11
A-12
Formula BiBr2+1 BiBr3 BiBr4-1 BiCl+2 BiCl2+1 BiCl3 BiF3 BiI3 BiNO3+2 BiOH+2 Br-1 Br2 Br2 Br3-1 Br3Pu BrO-1 BrO3-1 BrO4-1 C C10Cl10O C10Cl12 C10Cl8 C10H10 C10H10 C10H10 C10H10Cl2O2 C10H10O2 C10H10O2 C10H10O4 C10H10O4 C10H10O4 C10H12 C10H12 C10H12 C10H12 C10H12 C10H12 C10H12N2O5
Common/IUPAC Name Bismuth(III) dibromide ion(+1) Bismuth(III) bromide Bismuth(III) tetrabromide ion(-1) Bismuth(III) monochloride ion(+2) Bismuth(III) dichloride ion(+1) Bismuth(III) chloride Bismuth(III) fluoride Bismuth(III) iodide Bismuth(III) mononitrate ion(+2) Bismuth(III) monohydroxide ion(+2) Bromide ion (-1) Bromine Bromine Tribromide ion(-1) Plutonium(III) bromine Hypobromite(I) ion (-1) Bromate(VI) ion (-1) Perbromate(VII) ion (-1) Carbon (graphite) Decachloroketone Perchloropentacyclodecane Perchloronaphthalene 1,3-Diethenylbenzene 1-Methylindene 2-Methylindene 2,4-Dichlorophenoxy-1-methyl propanoate 5-(1-propenyl)-1,3-benzodioxole 5-Allyl-1,3-benzodioxole Dimethyl orthophthalate Dimethyl isophthalate Dimethyl terephthalate cis-2-Phenyl-2-butene Dicyclopentadiene 1,2,3,4-Tetrahydronaphthalene 5-Methylindan 2-Phenyl-1-butene trans-2-Phenyl-2-butene 2-sec-Butyl-4,6-dinitrophenol
Aspen HYSYSOLI Interface Name BIBR2ION BIBR3 BIBR4ION BICLION BICL2ION BICL3 BIF3 BII3 BINO3ION BIOHION BRION BR2 BR2EL BR3ION PUIIIBR3 BROION BRO3ION BRO4ION CEL KEPONE MIREX OCLNAPHTHA DVINYLBNZ MEINDEN1 MEINDEN2 SBUCLPHOXA ISOSAFROL SAFROLE DIMEPHTHAL DMIPHTALAT DMTEPHTHAL CPHEBU2EN2 DCPNTDIEN HDNAPH1234 MEINDAN5 PHEBU1EN2 TPHEBU2EN2 DINOSEB A-12
Formula C10H12N2O5 C10H12N2O8-4 C10H12O C10H12O C10H12O2 C10H12O4 C10H12O4 C10H14 C10H14 C10H14 C10H14 C10H14 C10H14 C10H14 C10H14 C10H14 C10H14 C10H14 C10H14 C10H14 C10H14 C10H14 C10H14 C10H14 C10H14 C10H14 C10H14 C10H14 C10H14O C10H14O C10H14O C10H14O C10H14O2 C10H15N C10H15N C10H16 C10H16 C10H16
Common/IUPAC Name 2,4-Dinitro-6-tert-butylphenol EDTA ion(-4) 3-Phenyl-1-propene Anethole 2-Methoxy-4-propenylphenol Diallyl maleate 3,4,5-Trimethoxybenzaldehyde 1-Phenylbutane p-Cymene 1,2-Diethylbenzene 2-Ethyl-1,3-dimethylbenzene 4-Ethyl-m-xylene 5-Ethyl-m-xylene 4-Ethyl-o-xylene 1,2-Dimethyl-3-ethylbenzene 2-Ethyl-1,4-dimethylbenzene Isobutylbenzene m-Cymene m-Diethylbenzene 1-Methyl-3-propylbenzene 1-Methyl-2-propylbenzene o-Cymene 1,4-Diethylbenzene sec-Butylbenzene 1,2,3,4-Tetramethylbenzene 1,2,3,5-Tetramethylbenzene 1,2,4,5-Tetramethylbenzene tert-Butylbenzene 5-Isopropyl-2-methylphenol 2-Methyl-4-(1-methylethenyl)-2cyclohexene-1-one 3-tert-Butylphenol p-tert-Butylphenol p-tert-Butylcatechol 2,6-Dethylaniline 1,1-Dimethyl-2-phenylethanamine 4-Isopropyl-1-methyl-1,5-cyclohexadiene alpha-Terpinene beta-Phellandrene
Aspen HYSYSOLI Interface Name DINOTERB EDTAION ALLYLANISL ANETHOLE IEUGENOL DALLYLMAL TMEBNAL345 BUTYLBNZ CYMENEP DIETBNZ12 ETMXYLEN2 ETMXYLEN4 ETMXYLEN5 ETOXYLEN4 ETOXYLENE3 ETPXYLEN2 IBUBNZ MCYMENE MDETBNZ ME1PRO3BNZ ME1PROBNZ2 OCYMENE PDETBNZ SECBUTYBNZ TMEBNZ1234 TMEBNZ1235 TMEBNZ1245 TTBUTYLBNZ CARVACROL CARVON MTTBUPHE PTTBUPHENL PTTBUCATE DETANIL26 PHETERMINE ALPHELLAND ALTERPINEN BEPHELLAND A-13
A-14
Formula C10H16 C10H16 C10H16 C10H16 C10H16 C10H16 C10H16O C10H16O4 C10H16O4-2 C10H17O4-1 C10H18 C10H18 C10H18O C10H18O2 C10H18O4 C10H19O2-1 C10H20 C10H20 C10H20O C10H20O C10H20O2 C10H20O2 C10H20O2 C10H22 C10H22 C10H22 C10H22 C10H22 C10H22 C10H22O C10H22O C10H22O C10H22O4 C10H22O4 C10H22O5 C10H23N C10H23N C10H24N+1
Common/IUPAC Name 2,2-Dimethyl-3-methylenenorbornane D-Limonene 4-Isopropyl-1-methyl-1,4-cyclohexadiene alpha-Pinene beta-Pinene Terpinolene 2-Bornanone Dipropyl cis-butenedioic acid Sebacic acid ion(-2) Hydrogen sebacic acid ion(-1) cis-Decahydronaphthalene Trans-Decahydronaphthalene alpha-Terpineol 5-Hexyldihydro-2(3H)-furanone Sebacic acid Decanoate ion(-1) n-Butylcyclohexane 1-Decene Decanal L-Menthol 1-Nonanecarboxylic acid 2-Ethylhexyl acetate Isopentyl isovalerate n-Decane 2-Methylnonane 3-Methylnonane 4-Methylnonane 5-Methylnonane 2,2-Dimethyloctane 1-Decanol Dipentyl ether 8-Methyl-1-nonanol Butoxytriethylene glycol Tripropylene glycol monomethyl ether Dimethoxytetraglycol Di-n-Pentylamine 1-Decylamine Hydrogen 1-decylamine ion(+1)
Aspen HYSYSOLI Interface Name CAMPHEN DLIMONEN GATERPINEN PINENEALP PINENEBETA TERPINOLEN CAMPHOR DPROMALEAT SEBACATION HSEBACATION CHD10NAPH THD10NAPHT ALTEROL GDECALACTN SEBACICAC DECANION BUCHXAN DECEN1 DECANAL1 MENTHOL1 DECNOICACI ET2HXLACET IPENTVALRT C10H22 MENONAN2 MENONAN3 MENONAN4 MENONAN5 MEOCTAN22 DECANOL1 DIPENTETH ME8NONOL1 TELNGLYBU TPROGLIME TEGLYDMETH DAMYLAMN DECYLAMN HDECYLAION
A-14
Formula C10H2Cl6 C10H4Cl2O2 C10H5Cl7 C10H5Cl7O C10H6Cl8 C10H6Cl8 C10H6Cl8 C10H6O2 C10H7Br C10H7Cl C10H7Cl C10H8 C10H8O C10H8O C10H9N C10H9N C11H10 C11H10 C11H11N2O2-1 C11H12Cl2O3 C11H12N2O2 C11H13N2O2+1 C11H14 C11H14 C11H14O C11H14O2 C11H14O2 C11H15NO3 C11H16 C11H16 C11H16 C11H16O C11H20O2 C11H21O2-1 C11H22 C11H22O C11H22O C11H22O2
Common/IUPAC Name 1,2,3,4,5,6-Hexachloronaphthalene 2,3-Dichloro-1,4-naphthalenedione 3-Chlorochlordene Epoxyheptachlor alpha-Chlordane Octachloro-4,7-methanotetrahydroindane trans-Chlordane 1,4-Naphthalenedione 1-Bromonaphthalene 2-Chloronaphthalene 1-Chloronaphthalene Naphthene 1-Naphthalenol 2-Naphthalenol 2-Naphthalenamine 1-Naphthalenamine 1-Methylnaphthalene 2-Methylnaphthalene L-Tryptophane ion(-1) 2-(2,4-Dichlorophenoxy)propyl acetate L-Tryptophane Hydrogen L-Tryptophane ion(+1) 4,6-Dimethylindan 4,7-Dimethylindan 1-(2,4,6-Trimethylphenyl)ethanone n-Butyl benzoate 4-tert-Butylbenzoic acid 2-Methylethoxyphenyl carbamate 1-Isopropyl-3,5-dimethylbenzene n-Pentylbenzene Pentamethylbenzene 4-tert-Amylphenol 2-Ethylhexyl acrylate Undecanoic acid ion(-1) 1-Undecene 2-Hendecanone Undecanal Methyl decanoate
Aspen HYSYSOLI Interface Name HXCLNAPHLN DICHLONE HEPTACHLOR HCLEPOX ALCHLORDAN CHLORDANE GCHLORDANE NAPHQUINON BRNAPHTH1 CLNAPHTH2 CLNAPTH1 NAPHTHALEN NAPHTHOL1 NAPTHOL2 NAPHTHLAM2 NAPHTHYAM1 ME1NAPHTH ME2NAPHTH LTRYPTOPHION DPROESTE24 HLTRYPTOPH H2LTRYPTOPHION MEINDAN46 MEINDAN47 TACETPHEON BUBNZAT TTBUBNZAC PROPOXUR IPRODMEBNZ PENTYLBNZ PMEBNZ PTTAMYLPHE ET2HXLACRY UNDECION UNDECEN1 MENONYLKET UNDECANAL1 MECAPRAT
A-15
A-16
Formula C11H22O2 C11H24 C11H24 C11H24 C11H24O C11H25N C12Cl8O C12Cl8O2 C12H10 C12H10 C12H10Cl2N2 C12H10Cl2N2O C12H10O C12H10O C12H11Cl3O3 C12H11N C12H11N C12H11N3 C12H12 C12H12 C12H12 C12H12 C12H12 C12H12 C12H12 C12H12 C12H12 C12H12 C12H12 C12H12N2 C12H12N2O C12H13Cl3O3 C12H14 C12H14Cl2O3 C12H14O4 C12H14O4 C12H16
Common/IUPAC Name Undecanoic acid n-Undecane 2-Methyldecane 4-Methyldecane n-Undecanol 1-Aminoundecane Octachlorodibenzofuran Octachlorodibenzo-p-dioxin 1,8-Ethylenenaphthalene 1,1'-Biphenyl 3,3'-Dichloro-4,4'-diaminobiphenyl 3,3'-Dichloro-4,4'-diaminodiphenyl ether Diphenyl ether 1-Hydroxy-2-phenylbenzene 2-(2,4-Dichlorophenoxy)-4-chloro-2butenyl acetate p-Aminodiphenyl Diphenylamine p-Aminoazobenzene 1,2-Dimethylnaphthalene 1,3-Dimethylnaphthalene 1,4-Dimethylnaphthalene 1,5-Dimethylnaphthalene 1,6-Dimethylnaphthalene 1,8-Dimethylnaphthalene 2,3-Dimethylnaphthalene 1-Ethylnaphthalene 2-Ethylnaphthalene 2,6-Dimethylnaphthalene 2,7-Dimethylnaphthalene 4,4'-Diaminodiphenyl 4,4'-Diaminodiphenyl ether 2-(2,4,5-Trichlorophenoxy)-1methylpropyl acetate 1,2,3-Trimethylindene 2-(2,4-Dichlorophenoxy)butylacetate Diethyl-o-phthalate Monoisobutylphthalate Cyclohexylbenzene
Aspen HYSYSOLI Interface Name UNDECACID C11H24 MEDECAN2 MEDECAN4 UNDECNOL1 UNDECYLAMN OCDF OCDBPOX ACENAPHTHN BIPHENYL DCBNZIDN33 DCDPHAMETH DIPHENETH HDPHEPHE1 DCLCROES24 AMNDPHE4 DIPHENAMN AMNAZOBNZ4 DMENAPH12 DMENAPH13 DMENAPH14 DMENAPH15 DMENAPH16 DMENAPH18 DMENAPH23 ETNAPH1 ETNAPH2 MENAPH26 MENAPH27 BENZIDINE DAMNDPHEOX TMEPROACET MEINDEN123 DBUACET24 DIETPHTHL MIBE CHXYLCBZ
A-16
Formula C12H18 C12H18 C12H18 C12H18O C12H20O C12H20O4 C12H22 C12H23N C12H23O2-1 C12H24 C12H24N+1 C12H24O C12H24O2 C12H26 C12H26O C12H26O C12H26O3 C12H27N C12H27N C12H27N C12H28N+1 C12H2Cl5O C12H2Cl6O C12H2Cl6O C12H2Cl6O C12H2Cl6O2 C12H3Cl5O C12H3Cl5O2 C12H4Cl4O C12H4Cl4O2 C12H8 C12H8 C12H8Cl6 C12H8Cl6O C12H8Cl6O C12H8Cl6O C12H8O C12H8S
Common/IUPAC Name m-Diisopropylbenzene p-Diisopropylbenzene 1-Phenylhexane 2,6-Diisopropylphenol 2-Cyclohexylcyclohexanone Dibutyl maleate Bicyclohexyl Dicyclohexylamine Lauric acid ion(-1) 1-Dodecene Hydrogen dicyclohexylamine ion(+1) 1-Dodecanal Lauric acid Dodecane Di-n-Hexyl ether 1-Dodecanol bis(2-Butoxyethyl) ether DI-n-Hexylamine n-Dodecylamine Tributylamine Hydrogen n-dodecylamine ion(+1) 2,3,4,7,8-Pentachlorodibenzofuran 1,2,3,6,7,8-Hexachlorodibenzofuran 1,2,3,4,7,8-Hexachlorodibenzofuran 2,3,4,6,7,8-Hexachlorodibenzofuran 1,2,3,6,7,8-Hexachloro-p-dioxin 1,2,3,7,8-Pentachlorodibenzofuran 1,2,3,7,8-Pentachlorodibenzo-p-dioxin 2,3,7,8-Tetrachlorodibenzofuran 2,3,7,8-Tetrachlorodibenzo-p-dioxin Acenaphthalene Biphenylene Aldrin Endrin ketone Aldrin epoxide Endrin Dibenzofuran Dibenzothiophene
Aspen HYSYSOLI Interface Name DIPROBNZ3 DISPRPBNZP HXYLBNZ DIPROPHE26 CHXLCHXON DBUMALEAT BCHXYL DCHXYLAMN DODECION DODECEN1 HDCHXYLAMION DODECANAL LAURICACID C12H26 DHXYLETH DODECANOL1 DETGLYBUET DINHXLAM DODECYLAMN TBUAMN HDODECYAION PCDF23478 HCBF123678 HCDBF12347 HDF234678 HCPD123678 PCDF12378 PCPDO12378 TCDF2378 TCDD2378 ANAPHLEN BPHELEN ALDRINE BENDRKET DIELDRINE EDRINE DBNZFURAN DBTHIOPHE
A-17
A-18
Formula C12H9BrO C12H9ClO C12HCl7O C12HCl7O2 C13H10 C13H10O C13H12 C13H12 C13H12Cl2N2 C13H14 C13H14 C13H14 C13H14N2 C13H20 C13H25O2-1 C13H26 C13H26O C13H26O2 C13H26O2 C13H26O2 C13H28 C13H28O C13H6Cl6O2 C13H8O C13H9N C14H10 C14H10 C14H10 C14H10Cl4 C14H12 C14H12 C14H12 C14H12 C14H12O2 C14H14 C14H14 C14H14O
Common/IUPAC Name 1-Bromo-4-phenoxybenzene 1-Chloro-4-phenoxybenzene 1,2,3,4,6,7,8-Heptachlorodibenzofuran 1,2,3,4,6,7,8-Heptachlorodibenzo-pdioxin 2,2'-Methylenebiphenyl Benzophenone Diphenylmethane 2-Methyl-1,1'-biphenyl 4,4'-Methylenebis(2-chlorobenzenamine) 2-Isopropylnaphthalene 2,3,5-Trimethylnaphthalene 2,3,6-Trimethylnaphthalene 4,4'-Methylenediamine 1-Heptylbenzene Tridecanoic acid ion(-1) 1-Tridecene Tridecanal n-Butyl nonanoate Methyl dodecanoate Tridecanoic acid n-Tridecane 1-Tridecanol 2,2'-Methylenebis(3,4,6-trichlorophenol) Fluorenone 2,3-Benzoquinoline Anthracene Diphenylacetylene Phenanthrene 1,1-Bis(4-chlorophenyl)-2,2dichloroethane (Z)-1,2-Diphenylethene 1-Methylfluorene 4-Methylfluorene trans-Stilbene Benzyl benzoate 1,1-Diphenylethane 1,2-Diphenylethane Benzyl ether
Aspen HYSYSOLI Interface Name BRPHOXBN1 CLPHEOBNZ HCLDBNZFRN HCLDBPDOX FLUORENE BNZPHENON DPHEME MEBIPHENL2 MOCA IPRONAPH MENAPH235 MENAPH236 MEDANILINE HEPTBNZ1 TDECATION C13H26 TRIDECANAL BUNONANOAT MELAURATE TDECNOICAC C13H28 TRIDECANL1 HCLPHENE FLUORENON ACRIDINE ANTHRACEN DPHEACELN PHENANTHR DDD44 CSTILBEN MEFLUOREN1 MEFLUOREN4 TSTILBEN BNZBNZAT DIPHENET11 DPHEET12 DBNZETH
A-18
Formula C14H16 C14H16N2 C14H16N2O2 C14H17Cl3O4 C14H18Cl2O4 C14H18N3O10-5 C14H18O4 C14H20O2 C14H22 C14H22O C14H22O C14H27O2-1 C14H28 C14H28O C14H28O2 C14H30 C14H30O C14H31N C14H8Cl4 C14H8O2 C14H9Cl5 C14H9Cl5 C14H9Cl5O C14H9NO2 C15H10 C15H11NO2 C15H12 C15H12 C15H12 C15H12 C15H13N C15H16O C15H16O C15H16O2 C15H24 C15H24O
Common/IUPAC Name 1-n-Butylnaphthalene o-Tolidine 3,3'-Dimethoxybenzidine 2-Butoxyethyl-2,4,5trichlorophenoxyacetate 2-Butoxyethyl-2-(2,4dichlorophenoxy)acetate DTPA ion(-5) Dipropyl phthalate 2,6-Di-tert-butylbenzoquinone 1-Octylbenzene 2,4-Di-tert-butylphenol p-tert-Octylphenol n-Tetradecoic acid ion(-1) 1-Tetradecene 2-Tetradecanone n-Tetradecanoic acid n-Tetradecane 1-Tetradecanol Tetradecylamine 4,4'-DDE Anthraquinone 2,4'-DDT p,p'-DDT 1,1-Bis(p-chlorophenyl)-2,2,2trichloroethanol 2-Amino-9,10-anthraquinone 4,5-Methylenephenanthrene 1-Amino-2-methylanthraquinone 2-Methylanthracene 9-Methylphenanthrene 2-Methylphenanthrene 1-Phenylindene 1-Phenanthrenemethanamine p-alpha-Cumylphenol p-Cumylphenol 2,2-Bis(p-hydroxyphenyl)propane n-Nonylbenzene 4-Nonylphenol
Aspen HYSYSOLI Interface Name BUNAPH1 OTOLUIDINE DMOXBNZDN BLADEX DBUOXETEST DTPAION DPROPHTH TTBUBNZQI OCTYLBNZ DTTBUPHE24 PTTOCTYPHE TEDEACION TETDECEN1 TEDECON2 MYRSTICACD C14H30 TEDECANOL1 TEDECYLAMN DDE44 ANTHRAQUI DDT24 DDT44 DICOFOL AMNANTRAQ2 MEPHENTHPE AMMEANTHQ MEANTHRA2 MEPHENANT9 MEPHTHR2 PHEINDEN1 MAMNPHTHR1 ALCUMYLPHL PCUMYLPHE BISPHENOLA NONYLBNZ PNONYLPHE
A-19
A-20
Formula C15H24O C15H26O C15H29O2-1 C15H30 C15H30O C15H30O2 C15H30O2 C15H32 C15H32O C15H33N C16H10 C16H10 C16H12 C16H12 C16H14 C16H14 C16H14Cl2O3 C16H15Cl3O2 C16H20 C16H21Cl3O3 C16H21Cl3O3 C16H22Cl2O3 C16H22O4 C16H22O4 C16H24 C16H26 C16H31O2-1 C16H32 C16H32 C16H32O2 C16H32O2 C16H34 C16H34O C16H34O C16H34S C17H10O
Common/IUPAC Name 2,6-DI-tert-Butyl-p-cresol 3,7,11-Trimethyl-1,6,10-dodecatrien-3-ol Pentadecanoic acid ion(-1) 1-Pentadecene 2-Pentadecanone Methyl tetradecanoate Pentadecanoic acid n-Pentadecane 1-Pentadecanol 1-Pentadecanamine Fluoranthene Pyrene 2-Phenylnaphthalene 1-Phenylnaphthalene 2,7-Dimethylphenanthrene 3,6-Dimethylphenanthrene 4,4'-Dichlorobenzilic acid ethyl ester 2,2-Bis(p-methoxyphenol)-1,1,1trichloroethane n-Hexylnaphthalene 2,4,5-Trichlorophenoxy-2ethylhexylacetate (2,4,5-Trichlorophenoxy)-(2,4,4trimethylpentyl)acetate Isooctyl (2,4-dichlorophenoxy)acetate Diisobutylphthalate Di-n-Butyl phthalate 6-Hexyltetralin n-Decylbenzene Palmitic acid ion(-1) 1-Hexadecene 1-Decylcyclohexane Ethyl tetradecanoate Palmitic acid n-Hexadecane Di-n-Octyl ether 1-Hexadecanol 1-Hexadecanethiol 7H-Benz[de]anthracen-7-one
Aspen HYSYSOLI Interface Name TTDCRESL26 NEROLIDOL PTDEATION PENTADECEN PNTDEON2 METDECAAT PNTDECAC C15H32 PNTDECANOL PDECANAMN1 FLUANTHEN PYRENE PHENAPH2 PHENNAPTH1 MEPHEN27 MEPHEN36 CLBNZLATE MEOXYCL HXYLNAPHTH THEXACE245 TIOCACE245 DOCTYACE24 DIBE DIBUTYPHTL HTDNAP1234 DECYLBNZ PALMATION C16H32 DECYLCHXN ETDECANOAT PALMITACID C16H34 DOCTYLETH HEXDECANOL CETYLMCTN BNZTHRON
A-20
Formula C17H12 C17H12 C17H14O5 C17H28 C17H33O2-1 C17H34 C17H34O2 C17H34O2 C17H36 C17H36O C18H12 C18H12 C18H12 C18H14 C18H14 C18H14 C18H20 C18H22 C18H30 C18H30O2 C18H32O2 C18H34O2 C18H34O4 C18H34O4 C18H35O2-1 C18H36 C18H36O2 C18H36O2 C18H38 C18H38O C18H38O C19H15O3 C19H16O4 C19H20O4 C19H26 C19H32 C19H34O2
Common/IUPAC Name Benzo[a]fluorene 2-Methylpyrene 3-(alpha-Acetonylfurfuryl)-4hydroxycoumarin 1-Phenylundecane Heptadecanoic acid ion(-1) 1-Heptadecene Heptadecanoic acid Methyl hexadecanoate n-Heptadecane 1-Heptadecanol Benzo[a]anthracene Chrysene Triphenylene m-Terphenyl o-Terphenyl p-Terphenyl 4-Methyl-2,4-diphenyl-1-pentene 2,3-Dimethyl-2,3-diphenyl butane Dodecylbenzene Linolenic acid Linoleic acid Oleic acid Dibutyl sebacate Dihexyl adipate Stearic acid ion(-1) 1-Octadecene Ethyl hexadecanoate Stearic acid n-Octadecane Dinonyl ether 1-Octadecanol Coumatetralyl 3-(alpha-Acetonylbenzyl)-4hydroxycoumarin Butyl benzyl phthalate 1-Nonylnaphthalene Tridecylbenzene Methyl cis,cis-9,12-octadecadienoate
Aspen HYSYSOLI Interface Name BNZFLUOREN MEPYREN2 COUMFURYL UNDECBNZ HPTDATION HEPTDECEN1 HPTDECNOAC MEHXDECNAT C17H36 HPTDECANL1 BNZANTHR CHRYSEN TPHENYLEN MTERPHENYL OTERPHENYL PTERPHENYL DPHME4PTE DMDPH23BU DDECYLBNZ LINOLENAC LINOLEICAC OLEICAC DBUSEBACAT DHXYLADIP STERATION OCTADECEN1 EHXDECAT STEARICACI C18H38 DINONYLETH OCTADECNL1 COUMTRALYL WARFARINE BUBNZPHTHA NONYLNAPH1 TDECYLBNZ MELINOL
A-21
A-22
Formula C19H36O2 C19H37O2-1 C19H38 C19H38O2 C19H38O2 C19H40 C19H40O C20H12 C20H12 C20H12 C20H12 C20H12 C20H16 C20H16 C20H28 C20H30O2 C20H31N C20H38O2 C20H39O2-1 C20H40 C20H40O2 C20H42 C20H42O C21H16 C21H20Cl2O3 C21H28O3 C21H44 C22H12 C22H12 C22H14 C22H28O5 C22H42O4 C22H42O4 C22H44O2 C22H46 C23H15ClO3 C23H16O4 C23H22O6
Common/IUPAC Name Methyl oleate Nonadecanoic acid ion(-1) 1-Nonadecene Methyl octadecanoate Nonadecanoic acid n-Nonadecane 1-Nonadecanol 2,3-Benzofluoranthene 10,11-Benzofluoranthene 11,12-Benzofluorene Benzo[a]pyrene Perylene 9,10-Dimethyl-1,2-benzanthracene Triphenylethylene 1-Decylnaphthalene Abietic acid Dehydroabietylamine Cetyl methacrylate 1-Eicosanoic acid ion(-1) 1-Eicosene 1-Eicosanoic acid n-Eicosane 1-Eicosanol 3-Methylbenza[j]aceanthrene Permethrin Pyrethrin I Heneicosane Benzo[ghi]perylene Indenopyrene Dibenzo[a,h]anthracene Pyrethrin II Di(2-ethylhexyl) adipate Dioctyl hexadioate n-Butyl stearate Docosane 2-[(p-Chlorophenyl)phenylacetyl]-1,3indandione 2-(Diphenylacetyl)-1,3-indandione Rotenone
Aspen HYSYSOLI Interface Name MEOLEATE NONDATION NONANDECN1 MEODECAT NONDECICAC C19H40 NONDECNOL1 BNZBFLUO BNZJFLUO BNZKFLUO BNZPYREN PERYLENE DMBNZAN712 TPHEETHLN DECYLNAPH1 ABIETICAC DMIPMAPHRN CETYMEACRY EICOATION EICOSEN1 EICOAC1 C20H42 EICOSANAL1 MEACANTHB3 PERMETHRN PYRETHRIN1 HENEICOSAN BNZPERLGHI INDENPYREN DBANTHAH PYRETHRIN2 BEHXLADIP DNODA BUSTEARAT DOCOSAN CLPHACINON DIPHACINON RETONON A-22
Formula C23H48 C24H14 C24H14 C24H14 C24H14 C24H38O4 C24H38O4 C24H38O4 C24H50 C25H52 C26H20 C26H54 C27H46O C27H56 C28H46O4 C28H58 C29H60 C2CaH3NO5 C2Cl2F4 C2Cl3F3 C2Cl4 C2Cl4F2 C2Cl4F2 C2Cl4O C2Cl6 C2ClF5 C2F4 C2F6 C2H2 C2H2Br4 C2H2Cl2 C2H2Cl2 C2H2Cl2 C2H2Cl2F2 C2H2Cl2F2 C2H2Cl2O C2H2Cl2O2 C2H2Cl4
Common/IUPAC Name Tricosane Dibenzo[a,e]pyrene Dibenzo(a,l)pyrene Dibenzo[a,h]pyrene Dibenzo[b,h]pyrene 2-Ethylhexyl phthalate Diisooctyl phthalate Di-n-octyl phthalate n-Tetracosane Pentacosane Tetraphenylethylene Hexacosane Cholesterol Heptacosane Diisodecyl phthalate n-Octacosane n-Nonacosane Calcium bicarbonate carbamate 1,2-Dichlorotetrafluoroethane 1,1,2-Trichlorotrifluoroethane 1,1,2,2-Tetrachloroethylene 1,1,2,2-Tetrachlorodifluoroethane 1,1,1,2-Tetrachlorodifluoroethane Trichloroacetyl chloride Perchloroethane 1-Chloro-1,1,2,2,2-pentafluoroethane Perfluoroethene Hexafluoroethane Acetylene 1,1,2,2-Tetrabromoethane cis-1,2-Dichloroethylene 1,1-Dichloroethylene trans-1,2-Dichloroethylene 1,2-Dichloro-1,1-difluoroethane 1,2-Dichloro-1,2-difluoroethane Chloroacetyl chloride 2,2-Dichloroacetic acid 1,1,1,2-Tetrachloroethane
Aspen HYSYSOLI Interface Name TRICOSAN DBNZPYRAE DBNZPYRAL DBPYRAH DBPYRAI BETHXPHTH2 DIOCTYLPHT DOPHTH TTCOSAN PENTCOSAN TPHEETLN HXCOSAN CHOLESTROL HPTCOSAN DIDECYLPHT OCTACOSAN NONACOSAN CAHCO3AMCT CL3FL4ET TCLTFETH CL4ETHEN CLFLET1122 TCLDFETH CL3ACETCL CL6ET CLFL5ET FL4ETHLN FL6ET ACETYLENE TBRE1122 DCLETC12 DCLETE11 TRDICLEE12 CL2FL2ETH CL2FL2ETHS CLACETCL CL2ACETAC CL4ET1112
A-23
A-24
Formula C2H2Cl4 C2H2ClF3 C2H2ClO2-1 C2H2F2 C2H2F4 C2H2O2 C2H2O4 C2H3Br C2H3BrO C2H3Cl C2H3Cl3 C2H3Cl3 C2H3ClO C2H3ClO2 C2H3F3 C2H3FO2 C2H3MgNO5 C2H3N C2H3NS C2H3O2-1 C2H3O3-1 C2H4 C2H4Br2 C2H4Br2 C2H4Cl2 C2H4Cl2 C2H4Cl2O C2H4F2 C2H4F2 C2H4N2O2 C2H4N2O6 C2H4NO2-1 C2H4O C2H4O C2H4O2 C2H4O2 C2H4O3 C2H4O4
Common/IUPAC Name 1,1,2,2-Tetrachloroethane 2-Chloro-1,1,1-trifluoroethane Chloroacetate ion(-1) 1,1-Difluoroethene 1,1,1,2-Tetrafluoroethane 1,2-Ethanedione Oxalic acid Bromoethene Acetyl bromide Vinyl chloride 1,1,1-Trichloroethane 1,1,2-Trichloroethane Acetyl chloride Chloroacetic acid 1,1,1-Trifluoroethane Fluoroacetic acid Minnesotaite Acetonitrile Methyl isothiocyanate Acetate ion(-1) Glycolate ion(-1) Ethene 1,1-Dibromoethane 1,2-Dibromoethane 1,1-Dichloroethane 1,2-Dichloroethane Dimethyl-1,1-dichloroether 1,1-Difluoroethane 1,2-Difluoroethane Oxamide Ethanediol dinitrate Glycinate ion(-1) Acetic aldehyde 1,2-Epoxyethane Acetic acid Methyl formate Glycolic acid Formic acid, dimer
Aspen HYSYSOLI Interface Name CL4ET1122 CLFL3ETH CLACETATION FL2ETHLN11 FL4ET1112 GLYOXAL OXALAC BRETHENE ACETBR VINYLCL CL3ET111 CL3ET112 ACETCL CLACETAC FL3ET111 FLACETAC MGHCO3AMCT ACENITRILE MEICYANT ACETATEION GLYCOLATION C2H4 BR2ET11 DBRE12 CL2ET11 CL2ET12 BISCLMEETH FL2ET11 FL2ET12 OXAMIDE ELNGLINTRT GLYCINATION ACETALDEHD ETHYLENOXD ACETACID MEFORMATE GLYCOLACID FORM2
A-24
Formula C2H5Br C2H5Cl C2H5ClO C2H5F C2H5I C2H5NO C2H5NO C2H5NO2 C2H5NO2 C2H6 C2H6NO2+1 C2H6O C2H6O C2H6O2 C2H6OS C2H6S C2H6S C2H6S2 C2H7N C2H7N C2H7NO C2H8N+1 C2H8N+1 C2H8N2 C2H8N2 C2H8NO+1 C2HBrClF3 C2HCl3 C2HCl3O C2HCl3O C2HCl3O2 C2HCl5 C2HClF4 C2HClF4 C2HF5 C2HO4-1 C2N2 C2O4-2
Common/IUPAC Name Bromoethane Ethyl chloride 2-Chloroethanol Ethyl fluoride Ethyl iodide Ethanamide N-Methylformamide Glycine Nitroethane Ethane Hydrogen glycine ion(+1) Dimethyl ether Ethanol 1,2-Ethanediol Dimethyl sulphoxide Dimethyl sulfide Ethanethiol Dimethyl disulfide Dimethylamine Ethylamine 2-Aminoethanol Hydrogen dimethylamine ion(+1) Hydrogen ethylamine ion(+1) Ethylenediamine 1,1-Dimethylhydrazine Hydrogen 2-Aminoethanol ion(+1) 1,1,1-Trifluoro-2-bromo-2-chloroethane Trichloroethylene 2,2-Dichloroacetyl chloride Trichloroacetaldehyde Trichloroethanoic acid Pentachloroethane 1-Chloro-1,1,2,2-tetrafluoroethane 1-Chloro-1,2,2,2-tetrafluoroethane Pentafluoroethane Hydrogen oxalate ion(-1) Cyanogen Oxalate ion(-2)
Aspen HYSYSOLI Interface Name EBROMID CLETHANE CLETNOL2 ETFL EIODID ACETAMIDE NMEFORM GLYCINE NITROET C2H6 HGLYCINION DMEETHER ETHANOL ETHEGLYCOL DIMESULFOX DMESFIDE ETMCAPTAN DMEDSFIDE DMEA ETAMINE MEXH DMEAHION ETAMHION ENAMN2 MEHYRAZN11 MEXH2ION HALOTHANE TCLETHLN CL2ACETCL CL3ACETAL CL3ACETAC CL5ET CL1F1122ET CLFL4ETH FL5ET HOXALATION CYANOGEN OXALATION
A-25
A-26
Formula C30H60O C30H62 C31H46O2 C31H64 C32H66 C33H68 C34H70 C35H72 C36H74 C3Cl6 C3F6 C3H10N+1 C3H10N+1 C3H10N+1 C3H2N2 C3H2O4-2 C3H3Cl C3H3ClO C3H3N C3H3O2-1 C3H3O4-1 C3H4 C3H4 C3H4Cl2 C3H4Cl2 C3H4Cl2 C3H4Cl2 C3H4Cl2O C3H4Cl2O2 C3H4N2O C3H4O C3H4O C3H4O2 C3H4O4 C3H5Br2Cl C3H5Cl C3H5Cl C3H5Cl3
Common/IUPAC Name 2-Tridecanone Tricontane Phytomenadione Hentriacontane n-Dotriacontane n-Tritriacontane n-Tetratriacontane n-Pentatriacontane n-Hexatriacontane 1,1,2,3,3,3-hexachloro-1-propene Perfluoro-1-propene Hydrogen isopropylamine ion(+1) Hydrogen propylamine ion(+1) Triethylamine ion(+1) Propanedinitrile Malonic acid ion(-2) 3-Chloro-1-propyne 2-Propenyl chloride 2-Propenenitrile Acrylate ion(-1) Hydrogen malonic acid ion(-1) 1,2-Propadiene 1-Propyne 2,3-Dichloropropene 1,1-Dichloropropene (E)-1,3-Dichloro-1-propene (Z)-1,3-Dichloro-1-propene 1,3-Dichloro-2-propanone 2-Chloroethyl chloroformate Cyanoacetamide 2-Propenal Propargyl alcohol Acrylic acid Malonic acid 1,2-Dibromo-3-chloropropane 1-Chloro-2-propene 2-Chloropropene 1,2,3-Trichloropropane
Aspen HYSYSOLI Interface Name TRIDECANN2 TRICONTAN VITAMK1 HENTRIACNT DOCTRIACON TTACONT TETRTRIACT PENTTRIACT HXTACONTAN HXCLPROPN1 FL6PRPLENE IPRAMHION PROPAMHION TRIMEAHION PRPADNTRIL MALONATION CL1PRPYNE3 ACRYLYLCL ACRYLONTRL ACRYLATEION HMALONATION ALLENE MEACETLEN CL2PRPEN23 CLPROPEN11 ECLPRPEN13 ZCLPRPEN13 CLPRP2ON13 CLECLFORMT CYACETAMD ACROLEIN2 PROPGLAL HACRYLATE MALONICAC BRCLPRP123 ALLYLCL CLPRPEN2 TCLPRP123
A-26
Formula C3H5ClO C3H5ClO2 C3H5ClO2 C3H5N3O9 C3H5NO C3H5NO C3H5O2-1 C3H5O3-1 C3H6 C3H6 C3H6Cl2 C3H6Cl2 C3H6Cl2 C3H6Cl2 C3H6Cl2O C3H6Cl2O C3H6N2 C3H6N2O2 C3H6N6O6 C3H6NO2-1 C3H6NO2-1 C3H6NO2-1 C3H6NO2-1 C3H6NO3-1 C3H6NO3-1 C3H6O C3H6O C3H6O C3H6O C3H6O C3H6O2 C3H6O2 C3H6O2 C3H6O3 C3H7Br C3H7Br C3H7Cl C3H7Cl
Common/IUPAC Name 1-Chloro-2,3-epoxypropane Ethyl chloroformate Methyl chloroacetate Trinitroglycerin 2-Propenamide 3-Hydroxypropanenitrile Propionic acid ion(-1) Lactic acid ion(-1) Propylene Cyclopropane 1,1-Dichloropropane 1,2-Dichloropropane 1,3-Dichloropropane 1,3-Dichloropropane 2,3-Dichloro-1-propanol 1,3-Dichloro-2-propanol 3-Aminopropanenitrile Malonamide sym-Trimethylenetrinitramine beta-Alanine ion(-1) DL-Alanine ion(-1) L-alpha-Alanine ion(-1) Sarcosine ion(-1) L-serine ion(-1) 2-Aminoethanol carboxy ion(-1) Acetone 2-Propen-1-ol Methyl vinyl ether Propionaldehyde 2-Methyloxiran Ethyl formate Propionic Acid Methylacetate Lactic acid 1-Bromopropane 2-Bromopropane n-Propyl chloride Isopropyl chloride
Aspen HYSYSOLI Interface Name CLEPOXPPN1 ETCLFORMAT MECLACET NLGLYCER ACRYLAMIDE HACRLNL PROPANATEION LACTATION C3H6 CYCLPRPN CL2PRPN11 DCLPRP12 DICLPRP13 PROPCL13 CLPROP1L23 CLPROP2L13 PROPAM3NL MALONAMD RDX BALANNION DLALANNION LALANNION SARCOSNION LSERNION MEXCO2ION ACETONE ALYLALCHOL MEVINETHER PRPIONALDH PRPYLOXD12 EFORMAT HPROPANATE MACTAT LACTICAC BRPRPAN1 BRPRPAN2 CLPRP1 CLPRP2
A-27
A-28
Formula C3H7ClO C3H7ClO C3H7I C3H7I C3H7NO C3H7NO C3H7NO C3H7NO2 C3H7NO2 C3H7NO2 C3H7NO2 C3H7NO2 C3H7NO2 C3H7NO2 C3H7NO2 C3H7NO3 C3H8 C3H8NO2+1 C3H8NO2+1 C3H8NO2+1 C3H8NO2+1 C3H8NO3+1 C3H8O C3H8O C3H8O C3H8O2 C3H8O3 C3H9N C3H9N C3H9N C40H82 C45H92 C4Cl6 C4F8 C4H10 C4H10 C4H10NO+1 C4H10NO2+1
Common/IUPAC Name 1-Chloro-2-propanol 2-Chloro-1-propanol Propyl iodide Isopropyl iodide N,N-Dimethylformamide N-Methylacetamide Propanamide beta-Alanine DL-Alanine Lactamide L-alpha-Alanine 1-Nitropropane 2-Nitropropane Sarcosine Ethyl carbamate L-Serine Propane Hydrogen beta-alanine ion(+1) Hydrogen DL-alanine ion(+1) Hydrogen L-alanine ion(+1) Hydrogen sarcosine ion(+1) Hydrogen L-serine ion(+1) 2-Propanol Methoxyethane 1-Propanol 1,2-Propanediol Glycerol Isopropylamine Propylamine Trimethylamine Tetracontane Pentatetracontane Perchlorobutadiene Octafluorocyclobutane n-Butane Isobutane Hydrogen morpholine ion(+1) Hydrogen 4-aminobutanoic acid ion(+1)
Aspen HYSYSOLI Interface Name CL1PROL2 CL2PROL1 IPRPAN1 IPRPAN2 DIMEFRMAMN NMEACETAMD PROPAMIDE BALANINE DLALANINE LACTAMID LALANINE NITPRPN1 NITPRPN2 SARCOSINE URETHAN LSERINE C3H8 HBALANION HDLALANION HLALANION HSARCOSNION HLSERNION ISPROPANOL MEETETHER PROPANOL1 PRPLNGLY12 GLYCEROL IPRPYLAM PROPYLAMN TRIMEAMINE TETRACONT PENTETRCON HXCL13BD FL8CYCBUTN C4H10 ISOBUTANE MORPHHION HAM4BUTNION
A-28
Formula C4H10NO2+1 C4H10NO2+1 C4H10O C4H10O C4H10O C4H10O C4H10O C4H10O C4H10O C4H10O2 C4H10O2 C4H10O2 C4H10O4 C4H10S C4H10S C4H10S C4H10S C4H11N C4H11N C4H11N C4H11N C4H11NO C4H11NO C4H11NO C4H11NO2 C4H11NO2 C4H12N+1 C4H12N+1 C4H12N+1 C4H12N+1 C4H12N2 C4H12NO+1 C4H12NO+1 C4H12NO+1 C4H12NO2+1 C4H12NO2+1
Common/IUPAC Name Hydrogen DL-2-aminobutyric acid ion(+1) Hydrogen 2-methylalanine ion(+1) Butanol Diethyl ether 2-Methyl-1-Propanol 2-Methoxypropane 1-Methoxypropane 2-Butyl alcohol tert-Butyl alcohol 1,4-Butanediol 2,3-Butanediol 1,2-Dimethoxyethane 1,2,3,4-Butanetetrol 1-Butanethiol 3-Thiapentane Isobutanethiol 2-Butanethiol 1-Butanamine N,N-Diethylamine Isobutylamine 2-Butanamine 2-Dimethylaminoethanol Dimethylethanolamine 3-Methoxypropylamine N,N-Diethanolamine 2-Aminoethoxyethanol Hydrogen 1-butaneamine ion(+1) Hydrogen N,N-diethylamine ion(+1) Hydrogen isobutylamine ion(+1) Hydrogen 2-butanamine ion(+1) Tetramethylenediamine Hydrogen dimethylethanolamine ion(+1) Hydrogen 2-dimethylaminoethanol ion(+1) Hydrogen 3-methoxypropylamine ion(+1) Hydrogen N,N-diethanolamine ion(+1) Hydrogen 2-aminoethoxyethanol ion(+1)
Aspen HYSYSOLI Interface Name HDLAM2BUTION HME2ALANION BUTYALCHOL EETHER ISBUALCHOL MEIPROETH MEPROPETH SBUTYALCH TTBUALCHOL BUTAN2HD14 BUTAN2HD23 MEOX2ME12 ERYTHRITOL BUTYLMCPT ET2SULFD IBUTYLMCPT SBUTYLMCPT BUTYLAMINE DIETHYLAMN IBUTYLAMN SECBUTYAMN DMEAMETL ME2ETNOAMN MOPA DEXH DGXH BUTYAMHION DIETAHION IBUTAMHION SECBUAHION TETMEDAMN DMETAMHION HDMEAMETLION MOPAHION DEXH2ION DGXH2ION
A-29
A-30
Formula C4H13N2+1 C4H14N2+2 C4H2O4-2 C4H2O4-2 C4H3O4-1 C4H3O4-1 C4H4 C4H4HoO6+1 C4H4N4 C4H4O C4H4O4 C4H4O4 C4H4O4-2 C4H4O5-2 C4H4O6-2 C4H4S C4H5Cl C4H5ClO C4H5ClO2 C4H5N C4H5NO4-2 C4H5NO4-2 C4H5O2-1 C4H5O2-1 C4H5O2-1 C4H5O4-1 C4H5O5-1 C4H5O6-1 C4H6 C4H6 C4H6 C4H6 C4H6Cl2 C4H6Cl2 C4H6Cl2 C4H6Cl2 C4H6Cl2O2 C4H6N2O2
Common/IUPAC Name Tetramethylenediammonium ion(+1) Tetramethylenediammonium ion(+2) Fumaric acid ion(-2) Maleic acid ion(-2) Hydrogen fumaric acid ion(-1) Hydrogen maleic acid ion(-1) Vinylacetylene Holmium(III) tatrtate ion(+1) 2,3-Diaminomaleonitrile Furan Fumaric acid Maleic acid Succinic acid ion(-2) Malic acid ion(-2) Tartrate ion(-2) Thiophene 2-Chloro-1,3-butadiene 2-Methyl-2-propenoyl chloride Methyl 2-chloro-2-propenoate Methylacrylonitrile IDA ion(-2) L-Aspartic acid ion(-2) cis-Crotonic acid ion(-1) Methacrylic acid ion(-1) trans-Crotonic acid ion(-1) Hydrogen succinic acid ion(-1) Hydrogen malic acid ion(-1) Hydrogen tartrate ion(-1) 1,3-Butadiene 1,2-Butadiene 1-Butyne 2-Butyne 3,4-dichloro-1-butene Cis-1,4-dichloro-2-butene alpha-1,3-Dichloro-2-butene 1,4-Dichloro-trans-2-butene 1,2-Dichloroethyl acetate Fumaramide
Aspen HYSYSOLI Interface Name HTETMEDAMNION H2TETMEDAMNION FUMARATEION MALEICION HFUMARATEION HMALEICION VINYACETYL HOTRTRTION DAMNDNTL FURAN FUMARACID H2MALEIC SUCCNATEION MALICTION TARTRTION THIOPHENE CLPRENE2 METHACRYCL MECLACRYL2 METACRYNTL IDAION LASPARION CCROTION MEACRLTION TCROTION HSUCCNATION HMALICTION HTARTRTION BUDIENE13 BUTADIEN12 ETACETYLEN ME2ACETNTL CL21BUTN34 CL2CBUTN14 CL2TBUYN13 DCLBUTE142 CLET12ACET FUMARAMD
A-30
Formula C4H6NO4-1 C4H6NO4-1 C4H6O C4H6O C4H6O C4H6O C4H6O2 C4H6O2 C4H6O2 C4H6O2 C4H6O2 C4H6O2 C4H6O3 C4H6O4 C4H6O5 C4H6O6 C4H7ClO C4H7ClO2 C4H7ClO2 C4H7ClO2 C4H7N C4H7N C4H7N2O3-1 C4H7N2O3-1 C4H7NO C4H7NO C4H7NO4 C4H7NO4 C4H7O2-1 C4H8 C4H8 C4H8 C4H8 C4H8 C4H8Cl2 C4H8Cl2 C4H8Cl2O C4H8N2O2
Common/IUPAC Name Hydrogen IDA ion(-1) Hydrogen L-aspartic acid ion(-1) 2,5-Dihydrofuran 2-Methylacrolein 3-Butene-2-one Divinyl ether Butynediol cis-Crotonic acid Methacrylic acid Methyl acrylate trans-Crotonic acid Vinyl acetate Acetyl anhydride Succinic acid Malic acid L-Tartaric acid 2-Chloroethoxyethene Ethyl chloroacetate Isopropyl chloroformate Propyl chloroformate Isobutyronitrile n-Butanenitrile N-Glycylglycine ion(-1) L-Asparagine ion(-1) Crotonamide 2-Methylacrylamide 2,2'-Iminobisacetic acid L-Aspartic acid n-Butanoic acid ion(-1) 1-Butene cis-2-Butene Cyclobutane Isobutene trans-2-Butene 1,4-Dichlorobutane 2,3-Dichlorobutane Di(2-chloroethyl) oxide Succinamide
Aspen HYSYSOLI Interface Name HIDAION HLASPION HYD2FURN25 METHACROLN MEVINYLKET VINY2ETHER BUTYNDIOL CCROTAC MEACRYLACD MEACRYLATE TCROTAC VINYLACET ACETANHYD H2SUCCNATE MALICAC H2TARTRT CLETOXETE2 ETCLACETAT IPROPCLFRT PROPCLFRMT ISBUNITRIL NBUTYRNTL GLYGLYCNION LASPARGION CROTONAMD MEACRYAMD2 H2IDA LASPARTAC BUTANION BUTENE1 CBUTEN CYCBUTAN ISOBUTENE TBUTEN CL2BUTAN14 DCLBN23 DICLETETH2 SUCCINAMD
A-31
A-32
Formula C4H8N2O3 C4H8N2O3 C4H8N8O8 C4H8NO2-1 C4H8NO2-1 C4H8NO2-1 C4H8NO3-1 C4H8NO4+1 C4H8NO4+1 C4H8O C4H8O C4H8O C4H8O C4H8O C4H8O C4H8O2 C4H8O2 C4H8O2 C4H8O2 C4H8O2 C4H8O2 C4H8O2 C4H8O4 C4H9Br C4H9Br C4H9Cl C4H9Cl C4H9Cl C4H9I C4H9N2O3+1 C4H9N2O3+1 C4H9NO C4H9NO C4H9NO C4H9NO2 C4H9NO2 C4H9NO2 C4H9NO2
Common/IUPAC Name N-Glycylglycine L-Asparagine 2,4,6,8H-N,N,N,N-Tetranitro-1,3,5,7tetrazocine 4-Aminobutanoic acid ion(-1) DL-2-Aminobutyric acid ion(-1) 2-Methylalanine ion(-1) Threonate ion(-1) Trihydrogen IDA ion(+1) Hydrogen L-aspartic acid ion(+1) 1,2-Butene oxide n-Butanal Ethoxyethene 2-Methylpropanal 2-Butanone Tetrahydrofuran n-Butanoic acid Cis-2-butene-1,4-diol 1,4-Dioxane Ethyl acetate Isopropyl formate Methyl propanoate Propyl formate Acetic acid, dimer 1-Bromobutane 2-Bromobutane 1-Chlorobutane 2-Chlorobutane tert-Butyl chloride 1-Iodobutane Dihydrogen N-glycylglycine ion(+1) Hydrogen L-asparagine ion(+1) 2-Methylpropanamide Morpholine N,N-Dimethylacetamide 4-Aminobutanoic acid DL-2-Aminobutyric acid 2-Hydroxy-2-methylpropaneamide 2-Methylalanine
Aspen HYSYSOLI Interface Name HGLYGLYCN LASPARAGN HMX AM4BUTNION DLAM2BUTION ME2ALANION LTHREONION H3IDAION H3LASPION BUTOXIDE12 BUTRALDEHY ETVINETHER IBUTALDHYD MEETKETONE THFURAN BUTYRICAC C2BUY14HD2 DIOXANEP EACTAT IPROPFORMT MEPRPANATE PRFORMAT ACET2 BRBUTAN1 BRBUTAN2 CLBUTAN1 SBUTYLCL TBUTYLCL IBUTAN1 H2GLYGLYCNION HLASPARGION MEPROPAMD MORPHOLN NNM2ACEAMD AM4BUTNICD DLAM2BUTCD H2ME2PRAMD ME2ALANINE A-32
Formula C4H9NO3 C50H102 C55H112 C5Cl6 C5H10 C5H10 C5H10 C5H10 C5H10 C5H10 C5H10 C5H10Cl2 C5H10Cl2O2 C5H10N2O3 C5H10NO2+1 C5H10NO2-1 C5H10NO2-1 C5H10NO2S-1 C5H10NO2S-1 C5H10NO3+1 C5H10NO4+1 C5H10NO4-1 C5H10NO4-1 C5H10O C5H10O C5H10O C5H10O C5H10O C5H10O2 C5H10O2 C5H10O2 C5H10O2 C5H10O2 C5H10O2 C5H10O2 C5H10O2 C5H10O3 C5H11Cl
Common/IUPAC Name L-Threonine Pentacontane Pentapentacontane Perchlorocyclopentadiene cis-2-Pentene 1-Pentene Cyclopentane 3-Methyl-1-butene 2-Methyl-2-butene 2-Methyl-1-butene trans-2-Pentene 1,5-Dichloropentane bis(2-Chloroethoxy)methane L-Glutamine Hydrogen L-proline ion(+1) L-Valine ion(-1) DL-Norvaline ion(-1) DL-Methionine ion(-1) L-Methionine ion(-1) Hydrogen 4-hydroxyproline ion(+1) Trihydrogen L-glutamic acid ion(+1) N,N-Diethanolamine carboxylate ion(-1) 2-Aminoethoxyethanol carboxylate ion(1) Cyclopentanol 2-Acetylpropane Valeric aldehyde Diethyl ketone 2-Pentanone n-Butyl formate Ethyl propanoate Isobutyl formate Isovaleric acid Methyl n-butyrate 2,2-Dimethylpropanoic acid n-Pentanoic acid Propyl acetate DL-Ethyl lactate 1-Chloropentane
Aspen HYSYSOLI Interface Name LTHREONINE PENTACONT PENPENTCON HXCLCYPNTD C2PENTEN C5H10 CYCLOPNTAN ME1BUTEN3 ME2BUTEN2 ME2BUTYN2 T2PENTEN CL2PNTAN15 BICLETOXME LGLUTAMINE H2LPROLINEION LVALINEION NORVALNION DLMETHNION LMETHINNION H2LHDPROLNION H3LGLUTION DEXCO2ION DGXCO2ION CYPNTNOL MEIPRPYKET PENTANAL1 PENTANON3 PNTANON2 BUTYLFARMT ETPROPNAT IBUTLFORMT IVALERICAC MENBUTYRAT MPROPANAT2 NPNTANOIAC NPROPYLACT ETLACTAT CLPNTAN1 A-33
A-34
Formula C5H11N2O3+1 C5H11NO2 C5H11NO2 C5H11NO2S C5H11NO2S C5H12 C5H12 C5H12 C5H12N2O C5H12NO2+1 C5H12NO2+1 C5H12NO2S+1 C5H12NO2S+1 C5H12O C5H12O C5H12O C5H12O C5H12O C5H12O C5H12O C5H12O C5H12O C5H12O C5H12O C5H12O C5H12O2 C5H12O4 C5H13N C5H13NO C5H13NO2 C5H14NO+1 C5H14NO2+1 C5H4O2 C5H4O4-2 C5H5N C5H5O4-1 C5H6 C5H6
Common/IUPAC Name Hydrogen L-glutamine ion(+1) L-Valine DL-Norvaline DL-Methionine L-Methionine n-Pentane Isopentane Neopentane N,N-Diethylurea Hydrogen L-valine ion(+1) Hydrogen DL-norvaline ion(+1) Hydrogen DL-methionine ion(+1) Hydrogen l-methionine ion(+1) 2,2-Dimethyl-1-propanol 2-Methyl-1-butanol 3-Methyl-1-butanol 3-Methyl-2-butanol tert-Amyl alcohol 1-Methoxy-2-methylpropane 1-Methoxybutane 2-Methoxybutane Methyl tert-butyl ether 1-Pentanol 2-Pentanol 3-Pentanol Neopentyl glycol Pentaerythritol n-Pentylamine Dimethylisopropanolamine Diethanolmethylamine Hydrogen dimethylisopropanolamine ion(+1) Hydrogen diethanolmethylamine ion(+1) 2-Furanaldehyde Itaconic acid ion(-2) Pyridine Hydrogen itaconic acid ion(-1) Cyclopentadiene 2-Methyl-1-butene-3-yne
Aspen HYSYSOLI Interface Name HLGLUTAMION LVALINE NORVALINE HDLMETHN HLMETHINN C5H12 IPENTAN NEOPENTANE NNDETUREA HLVALINEION HNORVALNION H2DLMETHNION H2LMETHINNION M22PRNL1 M2BTNOL1 M3BTNOL1 M3BTNOL2 ME2BUTNL2 MEIBUTETH MENBUTETH MESBUTETH METBUTETHR PENTANOL PENTNOL2 PENTNOL3 NEOPENTGLY PNTAERYTHR NPENTYLAMN DMIPA MDEXH DMIPAHION MDEXH2ION FURFURAL ITACONTION PYRIDINE HITACONTION CPENTADIEN ME1BUT3YN2 A-34
Formula C5H6 C5H6 C5H6N+1 C5H6O4 C5H6O4-2 C5H7NO2 C5H7NO2 C5H7NO2 C5H7NO2 C5H7NO2 C5H7NO2 C5H7NO2 C5H7NO2 C5H7NO4-2 C5H7O3-1 C5H7O4-1 C5H8 C5H8 C5H8 C5H8 C5H8 C5H8 C5H8 C5H8 C5H8 C5H8 C5H8 C5H8NO2-1 C5H8NO3-1 C5H8NO4-1 C5H8O C5H8O C5H8O2 C5H8O2 C5H8O2 C5H8O2 C5H8O3
Common/IUPAC Name 1-Pentene-3-yne 1-Pentene-4-yne Hydrogen pyridine ion(+1) Itaconic acid Glutaric acid ion(-1) Biomass, autotrophic active Biomass, autotrophic inert Biomass, heterotrophic active Biomass, heterotrophic inert Biomass, Nitrosomonas, autotrophic active Biomass, Nitrosomonas, autotrophic inactive Biomass, Nitrobacter, autotrophic active Biomass, Nitrobacter, autotrophic inactive L-Glutamic acid ion(-2) Levulinic acid ion(-1) Hydrogen glutaric acid ion(-1) Cyclopentene Isoprene 3-Methyl-1,2-butadiene 3-Methyl-1-butyne 1,3-Pentadiene 1,2-Pentadiene 1-Pentyne cis-1,3-Pentadiene 1,4-Pentadiene 2,3-Pentadiene trans-1,3-Pentadiene L-Proline ion(-1) 4-Hydroxyproline ion(-1) Hydrogen L-glutamic acid ion(-1) 2-Methyl-3-butyn-2-ol Methyl isopropenyl ketone 3-Acetoxypropene Ethyl acrylate Methyl methacrylate Vinyl propionate Levulinic acid
Aspen HYSYSOLI Interface Name PENTEN3YN1 PENTEN4YN1 HPYRIDINION ITACONAC GLUTARION BUGAACTIV BUGAINERT BUGHACTIV BUGHINERT BUGSACTIV BUGSINERT BUGBACTIV BUGBINERT LGLUTION LEVULTION HGLUTARION CPENTEN ISOPRENE ME12BUDIN3 ME1BUTYN3 PENTDIE132 PENTDIEN12 PENTYN1 PNTADIEN13 PNTADIEN14 PNTADIEN23 T13PNTDIEN LPROLINEION LHDPROLNION HLGLUTION MEBUTYNOL2 MEIPRPLKET ALLYLACET ETACRYLATE MEMECRYLAT NINYPRPIAT LEVULAC
A-35
A-36
Formula C5H8O4 C5H9N2O3-1 C5H9NO C5H9NO2 C5H9NO3 C5H9O2-1 C5H9O2-1 C60H122 C65H132 C6Cl6 C6H10 C6H10 C6H10 C6H10 C6H10 C6H10 C6H10 C6H10 C6H10Br2 C6H10Cl2 C6H10Cl2O C6H10N3+1 C6H10N3O2+1 C6H10O C6H10O C6H10O C6H10O2 C6H10O2 C6H10O2 C6H10O3 C6H10O4 C6H11ClO C6H11N C6H11N C6H11N3O2+2 C6H11NO C6H11O2-1 C6H11O3-1
Common/IUPAC Name Glutaric acid L-Glutamine ion(-1) 1-Methyl-2-pyrrolidinone L-Proline 4-Hydroxyproline 2,2-Dimethylpropanoic acid ion(-1) n-Pentanoic acid ion(-1) Hexacontane Pentahexacontane Perchlorobenzene cis,trans-2,4-Hexadiene Cyclohexene 1,5-Hexadiene 1-Hexyne 2-Hexyne 3-Hexyne 2,3-Dimethyl-1,3-butadiene trans,trans-2,4-Hexadiene 1,4-Dibromocyclohexane (E)-1,2-Dichlorocyclohexane 3,3-Dichloromethyloxolane Hydrogen 3,3'-iminobispropanenitrile ion(+1) Hydroxide histidine ion(+1) Cyclohexanone 3-(2-Propeneoxy)propene 2-Methyl-2-penten-4-one Ethyl methacrylate 1-Propyl acrylate 2-Oxacycloheptanone Propanoic anhydride Adipic acid (E)-4-Chlorocyclohexanol N,N-Diallylamine Hexanenitrile Dihydrogen histidine ion(+2) Cyclohexanone oxime Hexanoic acid ion(-1) 2-Hydroxycaproic acid ion(-1)
Aspen HYSYSOLI Interface Name GLUTARAC LGLUTAMION MEPYROLIDN HLPROLINE HLHDPROLN MPROPAT2ION PENTANION HEXACONT PENHEXCONT CL6BENZEN CT24HXDIEN CYCLOHEXEN HEXADIEN15 HEXYNE1 HEXYNE2 HEXYNE3 MEBU13EN23 TT24HXDIEN BRHXN14 ECLCHXN12 CLMEOXLN33 IMIN33HION H2LHISTIDNION CYCLHEXNON DIALLYETH MEPNTON432 ETMEACRYL NPROPYACRT OXCHEPNON2 PRPIOANHYD ADIPICACID ECLCHXNOL4 DIALLYLAMN HEXANNTRL H3LHISTIDNION CHEXNNOXIM HEXANION HYHEXATION A-36
Formula C6H12 C6H12 C6H12 C6H12 C6H12 C6H12 C6H12 C6H12 C6H12 C6H12 C6H12 C6H12 C6H12 C6H12 C6H12 C6H12 C6H12 C6H12 C6H12Cl2O C6H12N+1 C6H12NO2-1 C6H12NO2-1 C6H12NO2-1 C6H12NO2-1 C6H12NO2-1 C6H12O C6H12O C6H12O C6H12O C6H12O C6H12O C6H12O C6H12O C6H12O C6H12O2 C6H12O2 C6H12O2 C6H12O2
Common/IUPAC Name cis-2-Hexene cis-3-Hexene 1-Hexene Cyclohexane 2-Ethyl-1-butene 2-Methyl-1-pentene 3-Methyl-1-pentene 4-Methyl-1-pentene 2,3-Dimethyl-1-butene 3,3-Dimethyl-1-butene 2,3-Dimethyl-2-butene 2-Methyl-2-pentene cis-3-Methyl-2-pentene cis-4-Methyl-2-pentene Methylcyclopentane trans-4-Methyl-2-pentene trans-2-Hexene trans-3-Hexene 2,2'-Dichlorodiisopropyl ether Hydrogen N,N-diallylamine ion(+1) 6-Aminohexanoic acid ion(-1) DL-Isoleucine ion(-1) L-Isoleucine ion(-1) L-Leucine ion(-1) DL-Norleucine ion(-1) 1-(Ethenyloxy)-butane Cyclohexanol Ethyl isopropyl ketone 1-Hexanal 3-Hexanone 2-Hexanone 4-Methyl-2-pentanone 3,3-Dimethyl-2-butanone 3-Methylpentan-2-one 1-Butyl acetate 4-Methyl-2-pentanon-4-ol 2-Ethylbutyric acid Ethyl 2-methylpropanoate
Aspen HYSYSOLI Interface Name C2HEXENE C3HEXENE C6H12 CYCLOHEXAN ETBUT1EN2 ME1PENTNE2 ME1PENTNE3 ME1PENTNE4 ME2BU1EN23 ME2BU1EN33 ME2BU2EN23 ME2PENTEN2 MEC2PENTN3 MEC2PENTN4 MECPENTAN MET2PENTN4 T2HEXENE T3HEXENE CLIPROP2ET HDIALLYLION AMCAPRION DLILEUCNION LILEUCNION LLEUCINION NORLEUCION BUTVNYETH CHXANOL ETIPROPKET HEXANAL1 HEXANON3 HEXANONE2 M4PNTON2 ME2BU2ON33 MEPNTN2ON3 BUTLACETAT DIACETNALC ETBUTYRAC2 ETIBUTYRAT
A-37
A-38
Formula C6H12O2 C6H12O2 C6H12O2 C6H12O2 C6H12O2 C6H12O2 C6H12O2 C6H12O3 C6H12O3 C6H12O6 C6H12O6 C6H12O6 C6H12O6 C6H12O6 C6H12O6 C6H12O6.H2O C6H13Cl C6H13N4O2-1 C6H13NO2 C6H13NO2 C6H13NO2 C6H13NO2 C6H13NO2 C6H14 C6H14 C6H14 C6H14 C6H14 C6H14N4O2 C6H14NO2+1 C6H14NO2+1 C6H14NO2+1 C6H14NO2+1 C6H14NO2+1 C6H14O C6H14O C6H14O C6H14O
Common/IUPAC Name Ethyl n-butanoate Caproic acid Isobutyl acetate n-Pentyl formate Propyl propionate sec-Butyl acetate tert-Butyl acetate 2-Hydroxycaproic acid Paracetaldehyde beta-D-Fructose Levulose D-Glucose alpha-D-Glucose beta-D-Glucose beta-D-Fructose alpha-D-Glucose monohydrate 1-Chloro-n-hexane L-Arginine ion(-1) 6-Aminohexanoic acid DL-Isoleucine L-Isoleucine L-Leucine DL-Norleucine n-Hexane 2,2-Dimethylbutane 2,3-Dimethylbutane 2-Methylpentane 3-Methylpentane L-Arginine Hydrogen 6-aminohexanoic acid ion(+1) Hydrogen DL-isoleucine ion(+1) Hydrogen L-isoleucine ion(+1) Hydrogen L-leucine ion(+1) Hydrogen DL-norleucine ion(+1) 2-Isopropoxypropane n-Propyl ether 2-Ethyl-1-butanol 1-Hexanol
Aspen HYSYSOLI Interface Name ETNBUTYRAT HXNOICACID IBUTYLACET NPENTYLFMT NPROPPROPT SECBUTACET TTBUTACETT HYCAPRICAC PARALD FFURANOS FPYRANOS GLUCOS ADGLUC BDGLUC BDFRUC ADGLUC.H2O CLHXANE1 LARGINION AMCAPRACD DLILEUCINE LILEUCINE LLEUCINE NORLEUCINE C6H14 ME2BUTAN22 ME2BUTAN23 MEPENTAN2 MEPENTAN3 LARGININE HAMCAPRION HDLILEUCNION HLILEUCNION HLLEUCINION HNORLEUCION DIPROPETH DNPROPETH ET1BUTNOL2 HEXANOL
A-38
Formula C6H14O C6H14O C6H14O C6H14O C6H14O C6H14O C6H14O C6H14O2 C6H14O2 C6H14O2 C6H14O2 C6H14O3 C6H14O3 C6H14O6 C6H14O6 C6H14O6 C6H15N C6H15N C6H15N C6H15N C6H15N4O2+1 C6H15NO2 C6H15NO3 C6H16N+1 C6H16N+1 C6H16N+1 C6H16N+1 C6H16N2 C6H16N4O2+2 C6H16NO2+1 C6H16NO3+1 C6H17N2+1 C6H2Cl4 C6H2Cl4O C6H2Cl4O C6H3Cl3 C6H3Cl3 C6H3Cl3
Common/IUPAC Name 2-Hexanol 4-Methyl-2-pentanol 2-Methyl-1-pentanol 1-Methoxypentane n-Butyl ethyl ether tert-Butyl ethyl ether Butane, 2-methoxy-2-methyl1,1-Diethoxyethane 2-Butoxyethanol 1,2-Diethoxyethane 1,6-Hexanediol bis(2-Methoxyethyl) ether Trimethylolpropane Galactitol Mannitol Sorbitol Diisopropylamine n-Dipropylamine n-Hexylamine Triethylamine Hydrogen L-arginine ion(+1) Diisopropanolamine Triethanolamine Hydrogen diisopropylamine ion(+1) Hydrogen n-dipropylamine ion(+1) Hydrogen n-hexylamine ion(+1) Hydrogen triethylamine ion(+1) Hexamethylenediamine Dihydrogen L-arginine ion(+2) Hydrogen diisopropylamine ion(+1) Hydrogen triethanolamine ion(+1) Hydrogen hexamethylenediamine ion(+1) 1,2,4,5-Tetrachlorobenzene 2,3,4,6-Tetrachlorophenol 2,3,5,6-Tetrachlorophenol 1,3,5-Trichlorobenzene 1,2,3-Trichlorobenzene 1,2,4-Trichlorobenzene
Aspen HYSYSOLI Interface Name HEXNOL2 M4PTNOL2 ME1PNTNOL2 MENPENTETH NBUTETETHE TTBUTETETH TTPENTYETH ACETAL BUTOXETNL2 DIETOXTN12 HEXANIOL16 ETLN2GLM2E TMEPROPAN GALACTITOL MANNITOL SORBITOL DIIPROPAMN DPRAMINE NHEXYLAMN TRIEAMINE HLARGINION DIPXH TEXH DIIPRAMHION DPRAMHION HNHEXYLAMION TETHAMHION MELN6AMN2 H2LARGINION DIPXH2ION TEXH2ION HMELN6AION CLBNZ1245 CLPHEN2346 CLPHEN2356 CL3BNZ135 CLBNZ123 TCLBNZ124 A-39
A-40
Formula C6H3Cl3O C6H3Cl3O C6H3Cl3O C6H3Cl3O C6H3Cl3O C6H3N3O7 C6H4Br2 C6H4Br3N C6H4BrCl C6H4BrCl C6H4Cl2 C6H4Cl2 C6H4Cl2 C6H4Cl2O C6H4Cl2O C6H4ClNO2 C6H4ClNO2 C6H4ClNO2 C6H4N2O4 C6H4N2O4 C6H4N2O4 C6H4N2O5 C6H4N2O5 C6H4N2O5 C6H4NO2-1 C6H4O2 C6H4O2-2 C6H4O2-2 C6H4O2-2 C6H5Br C6H5BrO C6H5Cl C6H5Cl2N C6H5Cl2N C6H5Cl2N C6H5ClO C6H5ClO C6H5ClO
Common/IUPAC Name 2,3,5-Trichlorophenol 2,3,6-Trichlorophenol 2,4,5-Trichlorophenol 2,4,6-Trichlorophenol 3,4,5-Trichlorophenol 2,4,6-Trinitrophenol m-Dibromobenzene 2,4,6-Tribromoaniline 2-Bromochlorobenzene 1-Bromo-3-chlorobenzene m-Dichlorobenzene o-Dichlorobenzene p-Dichlorobenzene 2,4-Dichlorophenol 2,6-Dichlorophenol m-Chloronitrobenzene o-Chloronitrobenzene 1-Chloro-4-nitrobenzene 1,4-Dinitrobenzene m-Dinitrobenzene o-Dinitrobenzene 2,4-Dinitrophenol 2,5-Dinitrophenol 2,6-Dinitrophenol Nicotinic acid ion(-1) 1,4-Benzoquinone 1,2-Benzenediol ion(-2) 1,3-Benzenediol ion(-2) 1,4-Benzenediol ion(-2) Bromobenzene 2-Bromophenol Chlorobenzene 3,4-Dichloroaniline 2,3-Dichlorobenzenamine 2,4-Dichlorobenzenamine m-Chlorophenol o-Chlorophenol p-Chlorophenol
Aspen HYSYSOLI Interface Name CLPHENL235 CLPHENL236 CLPHENL245 CLPHENL246 CLPHENL345 PICRICAC MBR2BNZ BRANILN246 BRCL2BNZ BRCLBNZ3 MDCLBNZN ODCLBNZN PDCLBNZN CLPHENOL24 CLPHENOL26 MCLNITBNZ OCLNITBNZ PCLNITBNZ DINITBNZ14 MNIT2BNZ ONIT2BNZ NIPHENOL24 NIPHENOL25 NIPHENOL26 NICOTACDION QUINON BZDIOL12ION BZDIOL13ION BZDIOL14ION BRBENZEN BRPHENOL2 CLBENZEN CL2ANILN34 CLANILIN23 CLANILIN24 MCLPHENOL OCLPHENOL PCLPHENOL
A-40
Formula C6H5F C6H5I C6H5IO C6H5N3O4 C6H5NO2 C6H5NO2 C6H5NO3 C6H5NO3 C6H5NO3 C6H5O-1 C6H5O2-1 C6H5O2-1 C6H5O2-1 C6H5O7-3 C6H6 C6H6Cl6 C6H6Cl6 C6H6Cl6 C6H6Cl6 C6H6ClN C6H6ClN C6H6ClN C6H6N2O2 C6H6N2O2 C6H6N2O2 C6H6N3O4+1 C6H6NO2+1 C6H6NO6-3 C6H6O C6H6O2 C6H6O2 C6H6O2 C6H6O7-2 C6H7N C6H7O7-1 C6H8 C6H8 C6H8N2
Common/IUPAC Name Fluorobenzene Iodobenzene 4-Iodophenol 2,4-Dinitroaniline Nicotinic acid Nitrobenzene 2-Nitrophenol 3-Nitrophenol 4-Nitrophenol Phenol ion(-1) Hydrogen 1,2-benzenediol ion(-1) Hydrogen 1,3-benzenediol ion(-1) Hydrogen 1,4-Benzenediol ion(-1) Citrate ion(-3) Benzene 1,2,3,4,5,6-Hexachlorocyclohexane beta-1,2,3,4,5,6-Hexachlorocyclohexane 1,2,3,4,5,6-Hexachlorocyclohexane 1,2,3,4,5,6-Hexachlorocyclohexane o-Chloroaniline m-Chloroaniline 1-Amino-4-chlorobenzene 2-Nitraniline m-Nitroaniline 4-Nitroaniline Hydrogen 2,4-dinitroaniline ion(+1) Hydrogen nicotinic acid ion(+1) NTA ion(-3) Phenol 1,2-Benzenediol 1,3-Benzenediol 1,4-Benzenediol Hydrogen citrate ion(-2) Aniline Dihydrogen citrate ion(-1) 1,3-Cyclohexadiene Methylcyclopentadiene m-Phenylenediamine
Aspen HYSYSOLI Interface Name FBENZENE IBENZENE IPHENOL4 DNITANIL24 HNICOTACD NITBNZ NITPHENOL2 NITPHENOL3 NITPHENOL4 C6H5OION HBZDIOL12ION HBZDIOL13ION HBZDIOL14ION CITRATION BENZENE ALPHABHC BETABHC DELTABHC LINDANE CLANLN2 CLANLN3 CLANLN4 NITANL2 NITANL3 NITANLINEP HDNITANIL24ION H2NICOTACDION NTAION C6H5OH BNZDIOL12 BNZDIOL13 HYDRQUINON HCITRATION ANILINE H2CITRATION CHEXDIEN13 MECPENTD MPHEENAMN2
A-41
A-42
Formula C6H8N2 C6H8N2 C6H8N3O2-1 C6H8O C6H8O4-2 C6H8O7 C6H8O7.1H2O C6H9N3 C6H9N3O2 C6H9NO6 C6H9O4-1 C6HCl5 C6HCl5O C70H142 C75H152 C7H10 C7H10O2 C7H10O4-2 C7H11O4-1 C7H12 C7H12O2 C7H12O2 C7H12O2 C7H12O2 C7H12O4 C7H13O2-1 C7H14 C7H14 C7H14 C7H14 C7H14 C7H14 C7H14 C7H14 C7H14 C7H14 C7H14 C7H14
Common/IUPAC Name o-Phenylenediamine 1,4-Phenylenediamine Histidine ion(-1) 3-Methyl-2-cyclopentene-1-one Adipic acid ion(-2) Citric acid Citric acid monohydrate 3,3'-Iminobispropanenitrile Histidine Nitrilotriacetic acid Hydrogen adipic acid ion(-1) Pentachlorobenzene Pentachlorophenol Heptacontane Pentaheptacontane 2-Norbornene Allyl methacrylate Pimelic acid ion(-2) Hydrogen pimelic acid ion(-1) Cycloheptene n-Butyl acrylate Isobutyl acrylate Cyclohexanecarboxylic acid Propyl methacrylate Pimelic acid Heptanoic acid ion(-1) 1-Heptene Cycloheptane cis-2-Heptene cis-3-Heptene cis-1,2-Dimethylcyclopentane cis-1,3-Dimethylcyclopentane Ethylcyclopentane 2-Ethyl-1-pentene 3-Ethyl-1-pentene 2,3,3-Trimethyl-1-butene 1,1-Dimethylcyclopentane Methylcyclohexane
Aspen HYSYSOLI Interface Name OPHENLNAM2 PHENDIAMNP LHISTIDNION ME3CPENTEN ADIPATION CITRAC CITRAC.1H2O IMIN33PRNL HLHISTIDN H3NTA HADIPATION CL5BNZ CL5PHENOL HEPTCONT PENHEPTAC NORBORNEN2 ALLYMEACRT PIMELATION HPIMELATION CHEPTEN BUTACRYLAT IBUACRYLAT NAPHTHENAC PROMEACRL PIMELICAC HEPTANION C7H14 CHEPTAN CHEPTEN2 CHEPTEN3 CMECPENT12 CMECPENT13 ETCPENTAN ETPENTEN2 ETPENTEN3 MEBUTEN233 MECHEPTN11 MECHEXAN
A-42
Formula C7H14 C7H14 C7H14 C7H14 C7H14 C7H14 C7H14 C7H14NO4-1 C7H14O C7H14O C7H14O C7H14O C7H14O C7H14O C7H14O C7H14O C7H14O C7H14O C7H14O C7H14O C7H14O C7H14O C7H14O C7H14O2 C7H14O2 C7H14O2 C7H14O2 C7H14O2 C7H14O2 C7H14O2 C7H14O2 C7H14O3 C7H15Br C7H16 C7H16 C7H16 C7H16 C7H16
Common/IUPAC Name 2-Methyl-1-hexene 3-Methyl-1-hexene 4-Methyl-1-hexene trans-2-Heptene trans-3-Heptene trans-1,2-Dimethylcyclopentane trans-1,3-Dimethylcyclopentane Diisopropanolamine carboxylate ion(-1) cis-2-Methylcyclohexanol cis-3-Methylcyclohexanol cis-4-Methylcyclohexanol Heptanal 2-Heptanone 3-Heptanone 4-Heptanone 1-Methylcyclohexanol 2-Methylhexanal 3-Methylhexanal 5-Methyl-2-hexanone 2,4-Dimethyl-3-pentanone trans-2-Methylcyclohexanol trans-3-Methylcyclohexanol trans-4-Methylcyclohexanol Butyl propanoate Heptanoic acid Isopentyl acetate Ethyl isovalerate 1-Pentyl acetate Propyl n-butyrate sec-Amyl acetate 2,3-Dimethylpropylacetate Ethyl-3-ethoxypropanoate 1-Bromoheptane n-Heptane 3-Ethylpentane 2,2,3-Trimethylbutane 2-Methylhexane 3-Methylhexane
Aspen HYSYSOLI Interface Name MEHEXEN2 MEHEXEN3 MEHEXEN4 THEPTEN2 THEPTEN3 TMECPENT12 TMECPENT13 DIPXCO2ION CMECHXOL2 CMECHXOL3 CMECHXOL4 HEPTANAL1 HEPTANON2 HEPTANON3 HEPTANON4 MECHXOL1 MEHEXANAL2 MEHEXANAL3 MEHXON5 MEPENTON24 TMECHXOL2 TMECHXOL3 TMECHXOL4 BUPROPIONT HPNOICACID ISAMYACET IVALERAT PENTYLACET PROBUTYRAT SECAMLAC TTAMYLACET ETETOXPRT3 BRHEPTAN1 C7H16 ETPENTAN3 MEBUTAN223 MEHXAN2 MEHXAN3
A-43
A-44
Formula C7H16 C7H16 C7H16 C7H16 C7H16O C7H16O C7H16O C7H17N C7H18N+1 C7H3Br2NO C7H3Cl2N C7H4Cl2O C7H4Cl2O2 C7H4O3-2 C7H4O3-2 C7H4O3-2 C7H5Cl2NO2 C7H5Cl3 C7H5ClO2 C7H5ClO2 C7H5N C7H5N3O6 C7H5N5O8 C7H5O2-1 C7H5O3-1 C7H5O3-1 C7H5O3-1 C7H6Cl2 C7H6Cl2 C7H6Cl2 C7H6N2O4 C7H6N2O4 C7H6N2O4 C7H6N2O4 C7H6N2O4 C7H6NO2-1 C7H6O C7H6O2
Common/IUPAC Name 2,2-Dimethylpentane 2,3-Dimethylpentane 2,4-Dimethylpentane 3,3-Dimethylpentane 1-Heptanol 2-Heptanol 5-Methyl-1-hexanol 1-Heptanamine Hydrogen 1-Heptanamine ion(+1) 3,5-Dibromo-4-hydroxybenzonitrile 2,6-Dichlorobenzonitrile m-Chlorobenzoyl chloride 3,4-Dichlorobenzoic acid m-Salicylic acid ion(-2) Salicylic acid ion(-2) p-Salicylic acid ion(-2) 3-Amino-2,5-dichlorobenzoic acid alpha,alpha,alpha-Trichlorotoluene 3-Chlorobenzoic acid o-Chlorobenzoic acid Benzonitrile 2,4,6-Trinitrotoluene N-Methyl-N,2,4,6-tetranitroaniline Benzoic acid ion(-1) Hydrogen m-salicylic acid ion(-1) Hydrogen salicylic acid ion(-1) Hydrogen p-salicylic acid ion(-1) alpha,alpha-Dichlorotoluene 3,4-Dichlorotoluene 2,4-Dichlorotoluene 2,4-Dinitrotoluene 2,5-Dinitrotoluene 2,6-Dinitrotoluene 3,4-Dinitrotoluene 3,5-Dinitrotoluene 2-Aminobenzoic acid ion(-1) Benzaldehyde Benzoic acid
Aspen HYSYSOLI Interface Name MEPENTAN22 MEPENTAN23 MEPENTAN24 MEPENTAN33 HEPTANOL HEPTANOL2 ME5HXOL1 HEPTYLAMN HHEPTYLION BROMOXYNIL DICHLBENIL MCLBNZYLCL CLBNZAC34 MSALICYLION OSALICYLION PSALICYLION CHLORAMBEN BNZTRICL CLBNZAC3 OCLBNZICAC BNZONITRIL NITOLUN246 TETRYL BENZOATION HMSALICYLION HOSALICYLION HPSALICYLION BNZYLDICL CLMEBNZ234 DICLTOLU24 NITOLUEN24 NITOLUEN25 NITOLUEN26 NITOLUEN34 NITOLUEN35 AM2BNZATION BNZALDEHYD BNZACID
A-44
Formula C7H6O2 C7H6O3 C7H6O3 C7H6O3 C7H7Br C7H7Cl C7H7Cl C7H7Cl C7H7ClO C7H7NO C7H7NO2 C7H7NO2 C7H7NO2 C7H7NO2 C7H7NO3 C7H8 C7H8ClN C7H8N2O2 C7H8NO2+1 C7H8O C7H8O C7H8O C7H8O C7H8O C7H8O2 C7H8O2 C7H9N C7H9N C7H9N C7H9N C80H162 C8H10 C8H10 C8H10 C8H10 C8H10NO2+1 C8H10O C8H10O
Common/IUPAC Name 4-Hydroxybenzaldehyde m-Salicylic acid p-Salicylic acid Salicylic acid 4-Bromotoluene Benzyl chloride 2-Chlorotoluene 4-Chlorotoluene 4-Chloro-3-methylphenol Benzoylamide 2-Aminobenzoic acid m-Nitrotoluene 2-Nitrotoluene 4-Nitrotoluene 2-Nitroanisole Toluene 5-Chloro-2-methylbenzenamine 3,5-Diaminobenzoic acid Hydrogen 2-aminobenzoic acid ion(+1) Methoxybenzene alpha-Hydroxytoluene m-Cresol o-Cresol p-Cresol 2-Methoxyphenol 4-Methoxyphenol alpha-Hydroxytoluene 3-Toluidine o-Toluidine p-Toluidine Octacontane Ethylbenzene 1,3-Dimethylbenzene o-Xylene 1,4-Dimethylbenzene Hydrogen 2-(methylamino)benzoic acid ion(+1) 2,3-Xylenol 2,4-Xylenol
Aspen HYSYSOLI Interface Name HDBNZALD4 MSALICYLAC PSALICYLAC SALICYLAC BRTOLUEN4 BENZYLCL CLTOLUENEO CLTOLUENEP CL4ME3PHNL BNZAMID HAM2BNZAT NITTOLUNEM NITTOLUNEO NITTOLUNEP NITANISOL2 TOLUENE CL5M2BNZAM DAMBNZIC35 H2AM2BNZATION ANISOLE BNZYLALCHL MCRESOLE OCRESOLE PCRESOLE GUAIACOL MEOXPHENLP BNZYLAMN MTOLUIDINE TOLUIDINEO TOLUIDINEP OCTACONT ETBNZ MXYLENE OXYLENE PXYLENE H2MAMBNZACION DIMEPHNL23 DIMEPHNL24 A-45
A-46
Formula C8H10O C8H10O C8H10O C8H10O C8H10O C8H10O C8H10O C8H10O C8H10O C8H10O C8H10O C8H10O2 C8H10O2 C8H10O2 C8H10O2 C8H10O3 C8H10O4 C8H11N C8H11N C8H11NO C8H11NO C8H12 C8H12 C8H12O4 C8H12O4 C8H12O4-2 C8H13O4-1 C8H14 C8H14O2 C8H14O3 C8H14O4 C8H14O4 C8H15O2-1 C8H16 C8H16 C8H16 C8H16 C8H16
Common/IUPAC Name 2,5-Xylenol 2,6-Xylenol 4-Ethylphenol sec-Phenethyl alcohol 2-Methylbenzyl alcohol 3-Ethylphenol 2-Ethylphenol 2-Phenylethanol Phenetole 3,4-Xylenol 3,5-Xylenol 4-Ethyl-1,3-dihydroxybenzene 1,4-Dimethoxybenzene 2-Phenoxyethanol 1,2-Dimethoxybenzene 3,4-Dimethoxyphenol Ethylene diacrylate 2-Ethylaniline 2,4,6-Trimethylpyridine 2-Methoxy-5-methylbenzenamine p-Phenetidine 1,5-cyclooctadiene Vinylcyclohexene Diethyl maleate 2-Methyl-2-propene-1,1-dioldiacetate Suberic acid ion(-2) Hydrogen suberic acid ion(-1) Cyclooctene n-Butyl methacrylate Butyric anhydride Diethyl succinate Suberic acid Octanoic acid ion (-1) 1-Octene Cyclooctane cis-1,2-Dimethylcyclohexane cis-1,3-Dimethylcyclohexane cis-1,4-Dimethylcyclohexane
Aspen HYSYSOLI Interface Name DIMEPHNL25 DIMEPHNL26 ETPHENOLP ETPHENYL1 MEBNZYAMD2 METPHENOL OETPHENOL PHEETNOL2 PHENETOL XYLENOL34 XYLENOL35 ETRESORCNL MEOXBNZ14 PHENOXETL2 VERATROL MEOXPHEN34 GLYDIACRYL ETANILIN2 MPYRIDN246 PCRESIDINE PPHENETID COCTDIEN15 VINYLCHXEN DETMALEAT MEACROLACT SUBERATION HSUBERATION COCTENE BUMEACRYL BUTYRANHD DETSUCCINT SUBERICAC OCTANION C8H16 CCYCOCTAN CMECHEXN12 CMECHEXN13 CMECHEXN14
A-46
Formula C8H16 C8H16 C8H16 C8H16 C8H16 C8H16 C8H16 C8H16 C8H16 C8H16 C8H16 C8H16 C8H16 C8H16O C8H16O C8H16O C8H16O2 C8H16O2 C8H16O2 C8H16O2 C8H16O4 C8H18 C8H18 C8H18 C8H18 C8H18 C8H18 C8H18 C8H18 C8H18 C8H18 C8H18 C8H18 C8H18 C8H18 C8H18 C8H18 C8H18
Common/IUPAC Name Ethylcyclohexane 2-Ethyl-1-hexene Isopropylcyclopentane 1,1-Dimethylcyclohexane 1-Methyl-1-ethylcyclopentane 2,4,4-Trimethyl-1-pentene 2,4,4-Trimethyl-2-pentene Propylcyclopentane trans-1,2-Dimethylcyclohexane trans-1,3-Dimethylcyclohexane trans-1,4-Dimethylcyclohexane trans-2-Octene trans-3-Octene 2-Ethylhexanal Octanal 2-Octanone n-Butyl n-butyrate n-Hexyl acetate Isobutyl isobutyrate Octanoic acid 2-(2-Ethoxyethoxy)ethyl acetate n-Octane 3-Ethylhexane 2-Methyl-3-ethylpentane 3-Methyl-3-ethylpentane 2,2,3,3-Tetramethylbutane 2-Methylheptane 3-Methylheptane 4-Methylheptane 2,2-Dimethylhexane 2,3-Dimethylhexane 2,4-Dimethylhexane 2,5-Dimethylhexane 3,3-Dimethylhexane 3,4-Dimethylhexane 2,2,3-Trimethylpentane 2,2,4-Trimethylpentane 2,3,3-Trimethylpentane
Aspen HYSYSOLI Interface Name ETCYCLHEXN ETHEX1EN2 IPROCPENTN MECHEXN11 MEETCPEN11 MEPNTEN244 MPEN2EN244 PROCPENTAN TMECHEXN12 TMECHEXN13 TMECHEXN14 TOCTEN2 TOCTEN3 ETHEXAL2 OCTANAL1 OCTANON2 BUBUTYRAT HEXYLACET IBUIBUYRAT OCTANOICAC DEGEEACET C8H18 ETHXAN3 ME2ET3PNTN ME3ET3PNTN MEBUTN2233 MEHPTAN2 MEHPTAN3 MEHPTAN4 MEHXAN22 MEHXAN23 MEHXAN24 MEHXAN25 MEHXAN33 MEHXAN34 MEPNTAN223 MEPNTAN224 MEPNTAN233
A-47
A-48
Formula C8H18 C8H18O C8H18O C8H18O C8H18O C8H18O C8H18O C8H18O2 C8H18O3 C8H18O3 C8H18O4 C8H19N C8H19N C8H19N C8H20N+1 C8H20N+1 C8H20N+1 C8H4Cl2O2 C8H4O3 C8H4O4-2 C8H4O4-2 C8H4O4-2 C8H5Cl3O3 C8H5O4-1 C8H5O4-1 C8H5O4-1 C8H6 C8H6Cl2O3 C8H6Cl2O3 C8H6O C8H6O2 C8H6O4 C8H6O4 C8H6O4 C8H7ClO C8H7N C8H7O2-1 C8H7O2-1
Common/IUPAC Name 2,3,4-Trimethylpentane DI-n-Butyl ether Di-tert-butyl ether 2,2'-Oxybisbutane 2-Ethyl-1-hexanol 1-Octanol 2-Octanol 2-Hexyloxy-1-ethanol bis(2-Ethoxyethyl) ether Dipropylene glycol methyl ether 2,5,8,11-Tetraoxadodecane Di-n-Butylamine Diisobutylamine n-Octylamine Hydrogen di-n-butylamine ion(+1) Hydrogen diisobutylamine ion(+1) Hydrogen n-octylamine ion(+1) 1,3-Benzenedicarbonyl chloride Phthalic anhydride Isophthalic acid ion(-2) Phthalic acid ion(-2) Terephthalic acid ion(-2) (2,4,5-Trichlorophenoxy)acetic acid Hydrogen isophthalic acid ion(-1) Hydrogen phthalic acid ion(-1) Hydrogen terephthalic acid ion(-1) Ethynylbenzene 3,6-Dichloro-2-methoxybenzoic acid 2,4-Dichlorophenoxyacetic acid Benzofuran 1-Phthalanone Isophthalic acid Phthalic acid Terephthalic acid 2-Chloroacetophenone Phenylacetonitrile 3-Methylbenzoic acid ion(-1) o-Toluic acid ion(-1)
Aspen HYSYSOLI Interface Name MEPNTAN234 DIBUETHER DITTBUETH DSECBUETH ET2HXNOL1 OCTANOL1 OCTANOL2 HEXYLOXTOL DETGLYDEET PROGLIMETH TGLYDMETH DIBUTYAMN DIIBUAMN NOCTYLAMN HDIBUTAMION HDIIBUAMION HOCTYLION IPHTHAYLCL PHTHANHYDR IPHTHTION PHTHLTION TPHTHTION TACETAC245 HIPHTHTION HPHTHLTION HTPHTHTION ETHYNYLBNZ DICAMBA DPHEOXAC24 BNZFURAN PHTHALID IPHTHALAC PHTHALACID TERPHTHAAC CLACEPHENN PHENACENTL MTOLUION OTOLUION
A-48
Formula C8H7O2-1 C8H7O3-1 C8H8 C8H8NO2-1 C8H8O C8H8O C8H8O C8H8O C8H8O2 C8H8O2 C8H8O2 C8H8O2 C8H8O2 C8H8O3 C8H8O3 C8H9NO C8H9NO C8H9NO2 C9H10 C9H10 C9H10 C9H10 C9H10 C9H10 C9H10 C9H10 C9H10Cl2N2O C9H10NO2-1 C9H10NO2-1 C9H10NO3-1 C9H10O C9H10O2 C9H10O2 C9H10O2 C9H10O2 C9H10O2 C9H10O2 C9H10O2
Common/IUPAC Name p-Toluylic acid ion(-1) Phenoxyacetic acid ion(-1) Phenylethene 2-(Methylamino)benzoic acid ion(-1) 1-Phenyl-1-ethanone 2,3-Dihydrobenzofuran 4-Tolualdehyde Styrene oxide Benzeneacetic acid Methyl benzoate 3-Methylbenzoic acid p-Toluylic acid o-Toluic acid 2-(Methoxycarbonyl)phenol Phenoxyacetic acid N-Phenylacetamide 2-Phenylacetamide 2-(Methylamino)benzoic acid 3-Phenyl-1-propene 2-Phenyl-1-propene cis-1-Propenylbenzene Indan 1-Ethenyl-2-methylbenzene 1-Methyl-3-ethenylbenzene p-Methylstyrene trans-1-Propenylbenzene 1,1-Dimethyl-3-(3,4-dichlorophenyl)urea DL-3-Phenylalanine ion(-1) L-Phenylalanine ion(-1) Hydrogen L-tyrosine ion(-1) 1-Phenyl-1-propanone alpha-Acetoxytoluene Ethyl benzoate Methyl p-toluate 2,4-Dimethylbenzoic acid 2,5-Dimethylbenzoic acid 3,4-Dimethylbenzoic acid 3,5-Dimethylbenzoic acid
Aspen HYSYSOLI Interface Name PTOLUION PHOXACION STYRENE MAMBNZACION ACETPHENON HDBNZFUR23 PTOLUALD STYRENOX BNZACETAC MEBENZOATE MTOLUICAC PTOLUICAC TOLUCACIDO MESALICYL PHOXACAC ACETANILID PHENACEAMD HMAMBNZAC ALLYLBNZ ALMESTYREN CPROYLBNZ INDAN MESTYRENEO MMESTYREN PMESTYREN TPROYLBNZ1 DIURON DLPHALION LPHEALION HLTYROSNION PROPIOPHEN BNZYLACET ETBENZOAT ME4MEBNZAT MEBNZAC24 MEBNZAC25 MEBNZAC34 MEBNZAC35
A-49
A-50
Formula C9H10O2 C9H11NO2 C9H11NO2 C9H11NO3 C9H12 C9H12 C9H12 C9H12 C9H12 C9H12 C9H12 C9H12 C9H12 C9H12NO2+1 C9H12NO2+1 C9H12NO3+1 C9H12O C9H12O C9H12O C9H12O C9H12O C9H12O C9H12O C9H12O C9H12O C9H12O C9H12O3 C9H13N C9H13N C9H13N C9H14O C9H14O C9H14O4-2 C9H15O4-1 C9H16O4 C9H17O2-1 C9H18 C9H18
Common/IUPAC Name 3-Phenylpropionic acid DL-3-Phenylalanine L-Phenylalanine L-Tyrosine Isopropylbenzene 4-Ethyltoluene 2-Ethyltoluene m-Ethyltoluene 1,3,5-Trimethylbenzene Propylbenzene 1,2,3-Trimethylbenzene 1,2,4-Trimethylbenzene Vinylnorbornene Hydrogen DL-3-phenylalanine ion(+1) Hydrogen L-phenylalanine ion(+1) Hydrogen L-tyrosine ion(+1) Benzyl ethyl ether 2-Isopropylphenol 3-Isopropylphenol 4-Isopropylphenol 2-Phenyl-2-propanol 3-Phenyl-1-propanol 2,3,5-Trimethylphenol 2,4,5-Trimethylphenol 2,4,6-Trimethylphenol 3,4,5-Trimethylphenol 1,2,3-Trimethoxybenzene 1-Phenyl-2-aminopropane 2,4,5-Trimethylaniline 2,4,6-Trimethylbenzenamine Isophoron 2,6-Dimethyl-2,5-heptadiene-4-one Azelate ion(-2) Hydrogen azelate ion(-1) Azelaic acid Nonanoic acid ion(-1) (1-Methylethyl)cyclohexane n-Butylcyclopentane
Aspen HYSYSOLI Interface Name PHENPROPAC DLPHENLALN LPHENLALAN LTYROSINE CUMENE ETTOLUENEP MEETBNZ12 MEETBNZ13 MESITYLENE PROPYLBNZ TMEBNZ123 TMEBNZ124 VYNOBORNN HDLPHALION HLPHEALION H3LTYROSNION BNZLETETH IPROPPHEN2 IPROPPHEN3 IPROPPHEN4 PHE2PROOL2 PHENPROTL3 TMPHENL235 TMPHENL245 TMPHNOL246 TMPHNOL345 TMOXBNZ123 AMPHETAMN TMANILN245 TMEANLN246 ISOPHORONE MEHEPENON AZELATION HAZELATION AZELAICAC NONANION IPROCHXAN NBUCPENTEN
A-50
Formula C9H18 C9H18 C9H18O C9H18O C9H18O C9H18O C9H18O C9H18O2 C9H18O2 C9H18O2 C9H18O2 C9H18O2 C9H20 C9H20 C9H20 C9H20 C9H20 C9H20 C9H20 C9H20 C9H20 C9H20 C9H20 C9H20 C9H20 C9H20 C9H20 C9H20 C9H20O C9H20O C9H20O C9H21N C9H21N C9H22N+1 C9H6Cl8O C9H7Cl3O3 C9H7Cl3O3 C9H7N
Common/IUPAC Name 1-Nonene Propylcyclohexane Diisobutyl ketone 1-Nonanal 2-Nonanone 5-Nonanone 2,2,4,4-Tetramethyl-3-pentanone Butyl-3-methylbutanoate n-Butyl valerate Methyl octanoate Nonanoic acid n-Octyl formate n-Nonane 3,3-Diethylpentane 2,2-Dimethyl-3-ethylpentane 2,4-Dimethyl-3-ethylpentane 2,2-Dimethylheptane 2,6-Dimethylheptane 3-Ethylheptane 2,2,5-Trimethylhexane 2,4,4-Trimethylhexane 2-Methyloctane 3-Methyloctane 4-Methyloctane 2,2,3,3-Tetramethylpentane 2,2,3,4-Tetramethylpentane 2,2,4,4-Tetramethylpentane 2,3,3,4-Tetramethylpentane 2,6-Dimethyl-4-heptanol 1-Nonanol 2-Nonanol 1-Nonanamine Tripropylamine Hydrogen tripropylamine ion(+1) Isobenzan 2-(2,4,5-Trichlorophenoxy)propanoic acid Isooctyl 2-(2,4,5trichlorophenoxy)propionate Isoquinoline
Aspen HYSYSOLI Interface Name NONEN1 NPROCHEXN DIIBUKETON NONANAL1 NONANON2 NONANON5 TMPENN2244 BUTIVALERT BUVALERAT MEOCTAT NONOICACID OCTYLFMT C9H20 DETPENTN33 DMETPTN223 DMETPTN243 DMHEPTAN22 DMHEPTAN26 ETHEPTAN3 MEHXAN225 MEHXAN244 MEOCTAN2 MEOCTAN3 MEOCTAN4 MEPNTN2233 MEPNTN2234 MEPNTN2244 MEPNTN2334 MEHPT4OL26 NONANOL1 NONANOL2 NONYLAMN1 TPROAMN HTPROAION ISOBENZAN SILVEX TP245ESTER ISQUINOLN A-51
A-52
Formula C9H7N C9H8 C9H8Cl2O3 C9H8O C9H8O C9H8O2 C9H9N C9H9N C9H9N C9H9NO3-2 Ca Ca(Al2Si5O14).5H2O Ca(Al2Si6O16).5H2O Ca(CN)2 Ca(H2PO4)2 Ca(H2PO4)2.1H2O Ca(HC2O4)2 Ca(HCO3)2 Ca(HCO3)Cl Ca(HCO3)HS Ca(HCO3)HSO4 Ca(HCO3)OH Ca(HS)2 Ca(HSO3)2 Ca(HSO4)2 Ca(NbO3)2 Ca(NH2CO2)2 Ca(NO2)2 Ca(NO2)2.1H2O Ca(NO2)2.4H2O Ca(NO3)+1 Ca(NO3)2 Ca(NO3)2.3H2O Ca(NO3)2.4H2O Ca(OH)2 Ca(OH)Cl
Common/IUPAC Name Quinoline Indene Methyl (2,4-dichlorophenoxy)acetate 1-Indanone 2-Methylbenzofuran Cinnamic acid 2-Methyl-1H-indole 3-Methyl-1H-indole 3-Methyl-1H-indole L-Tyrosine ion(-2) Calcium Calcium dialuminum pentasilicate pentahydrate Calcium dialuminum hexasilicon hexadecaoxide pentahydrate Calcium cyanide Calcium dihydrogen orthophosphate(V) Calcium dihydrogen orthophosphate(V) monohydrate Calcium di(hydrogen oxalate) Calcium bicarbonate Calcium bicarbonate chloride Calcium bicarbonate bisulfide Calcium bicarbonate bisulfate Calcium bicarbonate hydroxide Calcium bisulfide Calcium bisulfite Calcium bisulfate Calcium diniobium(V) hexaoxide Calcium carbamate Calcium nitrite Calcium nitrite monohydrate Calcium nitrite tetrahydrate Calcium mononitrate ion(+1) Calcium nitrate Calcium nitrate trihydrate Calcium nitrate tetrahydrate Calcium hydroxide Calcium hydroxide chloride
Aspen HYSYSOLI Interface Name QUINOLINE INDENE DMEESTER24 INDANON1 MEBNZFUR2 CINNAMICAC MEINDOL2 MEINDOL3 MEINDOL5 LTYROSNION CAEL CAPHILL EPIS CACN2 CAH2PO42 CAH2PO42.1H2O CAHC2O42 CAHCO32 CAHCO3CL CAHCO3HS CAHCO3HSO4 CAHCO3OH CAHS2 CAHSO32 CAHSO42 CANBO32 CANH2CO22 CANO22 CANO22.1H2O CANO22.4H2O CANO3ION CANO32 CANO32.3H2O CANO32.4H2O CAOH2 CAOHCL
A-52
Formula Ca(VO3)2 Ca[C10H12N2O8]-2 Ca[C10H14N2O8] Ca[C14H18N3O10]-3 Ca[C2H3O2]+1 Ca[C2H3O2]2 Ca[C2H3O2]2.2H2O Ca[C2H3O2]2.H2O Ca[C2H3O3]+1 Ca[C2H3O3]2 Ca[C2H4NO2]+1 Ca[C2H4NO2]2 Ca[C3H5O2]+1 Ca[C3H5O2]2 Ca[C3H5O2]2.1H2O Ca[C3H6NO2]+1 Ca[C3H6NO2]2 Ca[C4H4O4] Ca[C4H4O6] Ca[C6H5COO]+1 Ca[C6H5COO]2 Ca[C6H5COO]2.3H2O Ca[C6H5O7]-1 Ca[C6H6NO6] Ca[C6H6NO6]-1 Ca[C6H6NO6]2-4 Ca[C7H4O3] Ca[C7H5O3]+1 Ca[Fe(CN)6]-1 Ca[Fe(CN)6]-2 Ca[H2C6H5O7]+1 Ca[H3C14H18N3O10] Ca[HC10H12N2O8]-1 Ca[HC14H18N3O10]-2 Ca[HC4H4O6]+1 Ca[HC6H5O7] Ca[HCOO]+1 Ca[HCOO]2
Common/IUPAC Name Calcium divanadium(V) hexaoxide Calcium EDTA ion(-2) Calcium dihydrogen EDTA Calcium DTPA ion(-3) Calcium monoacetate ion(+1) Calcium acetate Calcium acetate dihydrate Calcium acetate monohydrate Calcium monoglycolate ion(+1) Calcium glycolate Calcium monoglycine ion(+1) Calcium diglycine Calcium monopropionate ion(+1) Calcium propanate Calcium propanate monohydrate Calcium mono(l-alpha-alanine) ion(+1) Calcium di(l-alpha-alanine) Calcium succinate Calcium tartrate Calcium monobenzoate ion(+1) Calcium benzoate Calcium benzoate trihydrate Calcium monocitrate ion(-1) Calcium hydrogen NTA Calcium mono-NTA ion(-1) Calcium di-NTA ion(-4) Calcium salicylate Calcium hydrogen salicylate ion(+1) Calcium hexacyanoferric(III) ion(-1) Calcium hexacyanoferric(II) ion(-2) Calcium dihydrogen citrate ion(+1) Calcium trihydrogen DTPA Calcium hydrogen EDTA ion(-1) Calcium hydrogen DTPA ion(-2) Calcium hydrogen tartrate ion(+1) Calcium hydrogen citrate Calcium monoformate ion (+1) Calcium formate
Aspen HYSYSOLI Interface Name CAVO32 CAEDTAION CAH2EDTA CADTPAION CAACETION CAACET2 CAACET2.2H2O CAACET2.1H2O CAGLYCOLION CAGLYCOL2 CAGLYCINION CAGLYCIN2 CAPROPION CAPROP2 CAPROP2.1H2O CAALANION CAALAN2 CASUCCNATE CATARTRT CABENZOATION CABNZAT CABNZAT.3H2O CACTRTION CAHNTA CANTAION CANTA2ION CAOSALICYL CAHOSALICYLION CAFEIIICN6ION CAFEIICN6ION CAH2CTRTION CAH3DTPA CAHEDTAION CAHDTPAION CAHTARTRTION CAHCTRT CACOOHION CACOOH2
A-53
A-54
Formula Ca+2 Ca2[C14H18N3O10]-1 Ca2[Fe(CN)6] Ca2Al4Si8O24.7H2O Ca2Fe5Si8O22(OH)2 Ca2Mg5Si8O22F2 Ca3(AsO4)2 Ca3(BO3)2 Ca3(PO4)2 Ca3(VO4)2 Ca3[Fe(CN)6]2 CaAl2Si4O12.6H2O CaAl2Si7O18.6H2O CaBr2 CaBr2.4H2O CaBr2.6H2O CaC2O4 CaC2O4.1H2O CaCl2 CaCl2.2H2O CaCl2.4H2O CaCl2.6H2O CaCl2.CaO CaCl2.CaO.2H2O CaCl2.H2O CaCO3 CaCr2O7 CaCr2O7.4H2O CaCr2O7.5H2O CaCr2O7.6H2O CaCrO4 CaF+1 CaF2 CaH2BO3+1 CaH2PO4+1
Common/IUPAC Name Calcium ion(+2) Dicalcium DTPA ion(-1) Calcium ferrocyanide(II) Dicalcium tetraaluminum octasilicon tetracosaoxide heptahydrate Dicalcium pentairon octasilicon docosaoxide dihydroxide Dicalcium pentamaganesium octasilicon docosaoxide difluoride Calcium arsenate(V) Calcium orthoborate Calcium orthophosphate Calcium orthovanadate(V) Calcium ferricyanide(III) Dialuminum calcium tetrasilicon dodecaoxide hexahydrate Heulandite Calcium bromide Calcium bromide tetrahydrate Calcium bromide hexahydrate Calcium oxalate Calcium oxalate monohydrate Calcium chloride Calcium chloride dihydrate Calcium chloride tetrahydrate Calcium chloride hexahydrate Calcium chloride oxide Calcium chloride oxide dihydrate Calcium chloride monohydrate Calcium carbonate Calcium dichromate(VI) Calcium dichromate(VI) tetrahydrate Calcium dichromate(VI) pentahydrate Calcium dichromate(VI) hexahydrate Calcium chromate(VI) Calcium monofluoride ion(+1) Calcium fluoride Calcium dihydrogen borate ion(+1) Calcium dihydrogen orthophosphate(V) ion(+1)
Aspen HYSYSOLI Interface Name CAION CA2DTPAION CA2FEIICN6 LEON FERTREMLIT FLUTREMLIT CA3ASO42 CA3BO32 CA3PO42 CA3VO42 CA3FECN62 CHABAZITE HEULANDITE CABR2 CABR2.4H2O CABR2.6H2O CAC2O4 CAC2O4.1H2O CACL2 CACL2.2H2O CACL2.4H2O CACL2.6H2O CA2CL2O CA2CL2O.2H2O CACL2.1H2O CACO3 CACR2O7 CACR2O7.4H2O CACR2O7.5H2O CACR2O7.6H2O CACRO4 CAFION CAF2 CAH2BO3ION CAH2PO4ION
A-54
Formula CaH4TeO6 CaHC2O4+1 CaHCO3+1 CaHCO3HCO3 CaHPO4 CaHPO4.2H2O CaHSiO3+1 CaI2 CaMoO4 CaOH+1 CaPO4-1 CaS CaSe CaSeO3 CaSeO3.2H2O CaSeO4 CaSeO4.2H2O CaSiO2(OH)2 CaSO3 CaSO3.0.5H2O CaSO3.2H2O CaSO4 CaSO4.2H2O CaTe CaTeO3 CaTeO3.H2O CaTiO3 CaWO4 CBrCl3 CBrClF2 CCl2F2 CCl3F CCl3NO2 CCl4 CClF3 Cd Cd(C2O4)3-4
Common/IUPAC Name Calcium tetrahydrogen tellurium hexaoxide Calcium hydrogen oxalate ion(+1) Calcium bicarbonate ion(+1) Calcium di(bicarbonate) Calcium hydrogen orthophosphate(V) Calcium hydrogen orthophosphate(V) dihydrate Calcium hydrogen silicate ion(+1) Calcium iodide Calcium molybdate(VI) Calcium hydroxide ion(+1) Calcium orthophosphate(V) ion(-1) Cacium sulfide Calcium selenide Calcium selenite(IV) Calcium selenite(IV) dihydrate Calcium selenate(VI) Calcium selenate(VI) dihydrate Calcium silicon dioxide dihydroxide Calcium sulfite Calcium sulfite hemihydrate Calcium sulfite dihydrate Calcium sulfate Calcium sulfate dihydrate Calcium telluride Calcium tellurite Calcium tellurite monohydrate Calcium titanium trioxide Calcium tungsten tetraoxide Bromotrichloromethane Bromochlorodifluoromethane Dichlorodifluoromethane Fluorotrichloromethane Trichloronitromethane Carbon tetrachloride Chlorotrifluoromethane Cadmium Cadmium trioxalate ion(-4)
Aspen HYSYSOLI Interface Name CAH4TEO6 CAHC2O4ION CAHCO3ION CAHCO3HCO3 CAHPO4 CAHPO4.2H2O CAHSIO3ION CAI2 CAMOO4 CAOHION CAPO4ION CAS CASE CASEO3 CASEO3.2H2O CASEO4 CASEO4.2H2O CAH2SIO4 CASO3 CASO3.0.5H2O CASO3.2H2O CASO4 CASO4.2H2O CATE CATEO3 CATEO3.1H2O CATIO3 CAWO4 BRCL3ME BRCLF2C1 DICLDIFLME TRICLFLME TRICLNITME CARBNTET CLFL3ME CDEL CDC2O43ION
A-55
A-56
Formula Cd(C2O8)2-2 Cd(CN)2 Cd(CN)3-1 Cd(CN)4-2 Cd(HS)2 Cd(HS)3-1 Cd(HS)4-2 Cd(NH3)2+2 Cd(NH3)3+2 Cd(NH3)4+2 Cd(NH3)5+2 Cd(NH3)6+2 Cd(NO2)2 Cd(NO2)3-1 Cd(NO3)2 Cd(NO3)2.2H2O Cd(NO3)2.4H2O Cd(OH)2 Cd(OH)3-1 Cd(OH)4-2 Cd(SCN)2 Cd(SCN)3-1 Cd(SCN)4-2 Cd(SeCN)2 Cd[C10H12N2O8]-2 Cd[C14H18N3O10]-3 Cd[C2H3O2]+1 Cd[C2H3O2]2 Cd[C2H3O2]3-1 Cd[C2H3O3]+1 Cd[C2H3O3]2 Cd[C2H4NO2]+1 Cd[C2H4NO2]2 Cd[C2H7NO]+2 Cd[C2H7NO]2+2 Cd[C2H7NO]3+2 Cd[C2H8N2]+2 Cd[C2H8N2]2+2
Common/IUPAC Name Cadmium dioxalate ion(-2) Cadmium cyanide Cadmium tricyanide ion(-1) Cadmium tetracyanide ion(-2) Cadmium bisulfide Cadmium tri(hydrogen sulfide) ion(-1) Cadmium tetra(hydrogen sulfide) ion(-2) Cadmium diammonia ion(+2) Cadmium triammonia ion(+2) Cadmium tetraammonia ion(+2) Cadmium pentaammonia ion(+2) Cadmium hexaammonia ion(+2) Cadmium nitrite Cadmium trinitrite ion(-1) Cadmium nitrate Cadmium nitrate dihydrate Cadmium nitrate tetrahydrate Cadmium hydroxide Cadmium trihydroxide ion(-1) Cadmium tetrahydroxide ion(-2) Cadmium thiocyanate Cadmium trithiocyanate ion(-1) Cadmium tetrathiocyanate ion(-2) Cadmium selenocyanate Cadmium mono-EDTA ion(-2) Cadmium DTPA ion(-3) Cadmium monoacetate ion(+1) Cadmium acetate Cadmium triacetate ion(-1) Cadmium monoglycolate ion(+1) Cadmium glycolate Cadmium monoglycine ion(+1) Cadmium diglycine Cadmium mono(2-aminoethanol) ion(+2) Cadmium di(2-aminoethanol) ion(+2) Cadmium tri(2-aminoethanol) ion(+2) Cadmium mono(ethylenediamine) ion(+2) Cadmium di(ethylenediamine) ion(+2)
Aspen HYSYSOLI Interface Name CDC2O42ION CDCN2 CDCN3ION CDCN4ION CDHS2 CDHS3ION CDHS4ION CDNH32ION CDNH33ION CDNH34ION CDNH35ION CDNH36ION CDNO22 CDNO23ION CDNO32 CDNO32.2H2O CDNO32.4H2O CDOH2 CDOH3ION CDOH4ION CDSCN2 CDSCN3ION CDSCN4ION CDSECN2 CDEDTAION CDDTPAION CDACETION CDACET2 CDACET3ION CDGLYCOLION CDGLYCOL2 CDGLYCINION CDGLYCIN2 CDMEXHION CDMEXH2ION CDMEXH3ION CDEDAION CDEDA2ION A-56
Formula Cd[C2H8N2]3+2 Cd[C3H6NO2]+1 Cd[C3H6NO2]2 Cd[C4H11NO2]+2 Cd[C4H11NO2]2+2 Cd[C6H15NO3]+2 Cd[C6H15NO3]2+2 Cd[C6H15NO3]3+2 Cd[C6H5O7]-1 Cd[C6H6NO6]-1 Cd[C6H6NO6]2-4 Cd[H2C10H12N2O8] Cd[H2C14H18N3O10]1 Cd[H2C6H5O7]+1 Cd[H3C14H18N3O10] Cd[HC10H12N2O8]-1 Cd[HC14H18N3O10]-2 Cd[HC6H5O7] Cd[HC6H6NO6] Cd[HCOO]+1 Cd[HCOO]2 Cd[HCOO]2.2H2O Cd+2 Cd2[C14H18N3O10]-1 CdBr+1 CdBr2 CdBr2.4H2O CdBr3-1 CdBr4-2 CdC2O4 CdC2O4.3H2O CdCl+1 CdCl2 CdCl2.1H2O CdCl2.2.5H2O CdCl3-1
Common/IUPAC Name Cadmium tri(ethylenediamine) ion(+2) Cadmium mono(l-alpha-alanine) ion(+1) Cadmium di(l-alpha-alanine) Cadmium mono(N,N-diethanolamine) ion(+2) Cadmium di(N,N-diethanolamine) ion(+2) Cadmium monotriethanolamine ion(+2) Cadmium di(triethanolamine) ion(+2) Cadmium tri(triethanolamine) ion(+2) Cadmium citrate ion(-1) Cadmium mono-NTA ion(-1) Cadmium di-NTA ion(-4) Cadmium dihydrogen EDTA Cadmium dihydrogen DTPA ion(-1) Cadmium dihydrogen citrate ion(+1) Cadmium trihydrogen DTPA Cadmium hydrogen EDTA ion(-1) Cadmium hydrogen DTPA ion(-2) Cadmium monohydrogen citrate Cadmium hydrogen NTA Cadmium monoformate ion(+1) Cadmium formate Cadmium formate dihydrate Cadmium ion(+2) Dicadmium DTPA ion(-1) Cadmium bromide ion(+1) Cadmium bromide Cadmium bromide tetrahydrate Cadmium tribromide ion(-1) Cadmium tetrabromide ion(-2) Cadmium oxalate Cadmium oxalate trihydrate Cadmium monochloride ion(+1) Cadmium chloride Cadmium chloride monohydrate Cadmium chloride 2.5-hydrate Cadmium trichloride ion(-1)
Aspen HYSYSOLI Interface Name CDEDA3ION CDALANION CDALAN2 CDDEXHION CDDEXH2ION CDTEXHION CDTEXH2ION CDTEXH3ION CDCTRTION CDNTAION CDNTA2ION CDH2EDTA CDH2DTPAION CDH2CTRTION CDH3DTPA CDHEDTAION CDHDTPAION CDHCTRT CDHNTA CDCOOHION CDCOOH2 CDCOOH2.2H2O CDION CD2DTPAION CDBRION CDBR2 CDBR2.4H2O CDBR3ION CDBR4ION CDC2O4 CDC2O4.3H2O CDCLION CDCL2 CDCL2.1H2O CDCL2.2.5H2O CDCL3ION
A-57
A-58
Formula CdCl4-2 CdCN+1 CdCO3 CdF+1 CdF2 CdHS+1 CdI+1 CdI2 CdI3-1 CdI4-2 CdMoO4 CdNH3+2 CdNO2+1 CdNO3+1 CdOH+1 CdS CdSCN+1 CdSe CdSeCN+1 CdSeO3 CdSeO3.0.5H2O CdSeO4 CdSeO4.1H2O CdSeO4.2H2O CdSO4 CdSO4.2.6H2O CdSO4.H2O CdWO4 Ce Ce(C2O4)2-1 Ce(C2O4)3-3 Ce(NO3)3 Ce(NO3)3.6H2O Ce(NO3)4 Ce(OH)2+1 Ce(OH)3 Ce(OH)4-1 Ce(SO4)2-1
Common/IUPAC Name Cadmium tetrachloride ion(-2) Cadmium cyanide ion(+1) Cadmium carbonate Cadmium monofluoride ion(+1) Cadmium fluoride Cadmium bisulfide ion(+1) Cadmium monoiodide ion(+1) Cadmium iodide Cadmium triiodide ion(-1) Cadmium tetraiodide ion(-2) Cadmium molybdate(VI) Cadmium ammonia ion(+2) Cadmium mononitrite ion(+1) Cadmium mononitrate ion(+1) Cadmium monohydroxide ion(+1) Cadmium sulfide Cadmium monothiocyanate ion(+1) Cadmium selenide Cadmium monoselenocynate ion(+1) Cadmium selenite Cadmium selenite hemihydrate Cadmium selenate Cadmium selenate monohydrate Cadmium selenate dihydrate Cadmium sulfate Cadmium sulfate 2.6 hydrate Cadmium sulfate monohydrate Cadmium tungstate Cerium Cerium(III) dioxalate ion(-1) Cerium(III) trioxalate ion(-3) Cerium(III) nitrate Cerium(III) nitrate hexahydrate Cerium(IV) nitrate Cerium(III) dihydroxide ion(+1) Cerium(III) hydroxide Cerium(III) tetrahydroxide ion(-1) Cerium(III) disulfate ion(-1)
Aspen HYSYSOLI Interface Name CDCL4ION CDCNION CDCO3 CDFION CDF2 CDHSION CDIION CDI2 CDI3ION CDI4ION CDMOO4 CDNH3ION CDNO2ION CDNO3ION CDOHION CDS CDSCNION CDSE CDSECNION CDSEO3 CDSEO3.0.5H2O CDSEO4 CDSEO4.1H2O CDSEO4.2H2O CDSO4 CDSO4.2.6H2O CDSO4.1H2O CDWO4 CEEL CEC2O42ION CEC2O43ION CENO33 CENO33.6H2O CEIVNO34 CEOH2ION CEOH3 CEOH4ION CESO42ION
A-58
Formula Ce(SO4)2-1 Ce[C10H12N2O8]-1 Ce[C14H18N3O10]-2 Ce[C2H3O2]+2 Ce[C2H3O2]2+1 Ce[C2H3O2]3 Ce[C6H5O7] Ce[C6H5O7]2-3 Ce[C6H6NO6] Ce[C6H6NO6]2-3 Ce[H2C14H18N3O10] Ce[HC10H12N2O8] Ce+3 Ce+4 Ce2(C2O4)3 Ce2(C2O4)3.9H2O Ce2(CO3)3 Ce2(SO4)3 Ce2(WO4)3 Ce2O3 Ce2S3 CeBr3 CeC2O4+1 CeCl+2 CeCl2+1 CeCl3 CeCl4-1 CeCO3+1 CeF+2 CeF2+1 CeF3 CeF4-1 CeH2PO4+2 CeHCO3+2 CeI3 CeNO3+2 CeO2 CeOH+2
Common/IUPAC Name Cerium(III) monosulfate ion(+1) Cerium(III) EDTA ion(-1) Cerium(III) DTPA ion(-2) Cerium(III) monoacetate ion(+2) Cerium(III) diacetate ion(+1) Cerium(III) acetate Cerium(III) citrate Cerium(III) dicitrate ion(-2) Cerium(III) NTA Cerium(III) di-NTA ion(-3) Cerium(III) dihydrogen DTPA Cerium(III) hydrogen EDTA Cerium ion(+3) Cerium ion(+4) Cerium(III) oxalate Cerium(III) oxalate nonahydrate Cerium(III) carbonate Cerium(III) sulfate Cerium(III) tungstate Cerium(III) oxide Cerium(III) sulfide Cerium(III) bromide Cerium(III) monooxalate ion(+1) Cerium(III) monochloride ion(+2) Cerium(III) dichloride ion(+1) Cerium(III) chloride Cerium(III) tetrachloride ion(-1) Cerium(III) monocarbonate ion(+1) Cerium(III) monofluoride ion(+2) Cerium(III) difluoride ion(+1) Cerium(III) fluoride Cerium(III) tetrafluoride ion(-1) Cerium(III) dihydrogen orthophosphate ion(+2) Cerium(III) bicarbonate ion(+2) Cerium(III) iodide Cerium(III) mononitrate ion(+2) Cerium(IV) oxide Cerium(III) monohydroxide ion(+2)
Aspen HYSYSOLI Interface Name CESO4ION CEEDTAION CEDTPAION CEACETION CEACET2ION CEACET3 CECTRT CECTRT2ION CENTA CENTA2ION CEH2DTPA CEHEDTA CEION CEIVION CE2OX3 CE2OX3.9H2O CE2CO33 CE2SO43 CE2WO43 CE2O3 CE2S3 CEBR3 CEC2O4ION CECLION CECL2ION CECL3 CECL4ION CECO3ION CEFION CEF2ION CEF3 CEF4ION CEH2PO4ION CEHCO3ION CEI3 CENO3ION CEO2 CEOHION A-59
A-60
Formula CePO4 CePO4.2H2O CF4 CH2Br2 CH2BrCl CH2Cl2 CH2ClF CH2F2 CH2I2 CH2O CH2O2 CH3Br CH3Cl CH3F CH3I CH3NO CH3NO2 CH3S-1 CH4 CH4N2O CH4N4O2 CH4O CH4S CH5N CH6N+1 CHBr2Cl CHBr3 CHBrCl2 CHCl3 CHClF2 CHF3 CHO2-1 Cl-1 Cl2 ClCN ClO-1 ClO2 ClO2-1
Common/IUPAC Name Cerium(III) orthophosphate Cerium(III) orthophosphate dihydrate Carbon tetrafluoride Dibromomethane Bromochloromethane Dichloromethane Chlorofluoromethane Difluoromethane Diiodomethane Formaldehyde Formic acid Methyl bromide Methyl chloride Methyl fluoride Methyl Iodide Formamide Carbamic acid Methanethiol ion(-1) Methane Urea Nitroguanidine Methanol Methanethiol Methylamine Hydrogen methylamine ion(+1) Dibromochloromethane Bromoform Bromodichloromethane Chloroform Chlorodifluoromethane Trifluoromethane Formate ion(-1) Chloride ion(-1) Chlorine Cyanogen chloride Hypochlorite ion(-1) Chlorine dioxide Chlorite ion(-1)
Aspen HYSYSOLI Interface Name CEPO4 CEPO4.2H2O FL4ME DBRMETHN BRCLME DCLMETHN CLFLME FL2ME DIIMETHN FORMALDHYD HCOOH MBROMID CLME FLME IMETHAN FORMAMIDE HNH2CO2 CH3SION CH4 UREA NITGUANID METHANOL MEMERCAPTN MEAMINE MEAMHION BR2CLME BROMFORM BRCL2ME CHLOROFM CLFL2ME FL3ME COOHION CLION CL2 CYANOGENCL CLOION CLO2 CLO2ION
A-60
Formula ClO3-1 ClO4-1 CN-1 CNO-1 CO Co Co(C2O4)2-2 Co(C2O4)3-4 Co(NH3)+2 Co(NH3)2+2 Co(NH3)3+2 Co(NH3)4+2 Co(NH3)5+2 Co(NH3)6+2 Co(NH3)6+3 Co(NO3)2 Co(NO3)2.2H2O Co(NO3)2.3H2O Co(NO3)2.4H2O Co(NO3)2.6H2O Co(OH)2 Co(OH)3 Co(OH)3-1 Co(OH)4-2 Co(SCN)2 Co(SeCN)2 Co[C10H12N2O8]-2 Co[C10H14N2O8] Co[C14H18N3O10]-3 Co[C2H3O2]+1 Co[C2H3O2]2 Co[C2H3O2]3-1 Co[C2H3O3]+1 Co[C2H3O3]2 Co[C2H4NO2]2 Co[C2H8N2]+2 Co[C2H8N2]2+2 Co[C2H8N2]3+2
Common/IUPAC Name Chlorate ion(-1) Perchlorate ion(-1) Cyanide ion(-1) Cyanate ion(-1) Carbon monoxide Cobalt Cobalt(II) dioxalate ion(-2) Cobalt(II) trioxalate ion(-4) Cobalt(II) monoammonia ion(+2) Cobalt(II) diammonia ion(+2) Cobalt(II) triammonia ion(+2) Cobalt(II) tetraammonia ion(+2) Cobalt(II) pentaammonia ion(+2) Cobalt(II) hexaammonia ion(+2) Cobalt(III) hexaammonia ion(+3) Cobalt(II) nitrate Cobalt(II) nitrate dihydrate Cobalt(II) nitrate trihydrate Cobalt(II) nitrate tetrahydrate Cobalt(II) nitrate hexahydrate Cobalt(II) hydroxide Cobalt(III) hydroxide Cobalt(II) trihydroxide ion(-1) Cobalt(II) tetrahydroxide ion(-2) Cobalt(II) thiocyanate Cobalt(II) selenocyanate Cobalt(II) EDTA ion(-2) Cobalt(II) dihydrogen EDTA Cobalt(II) DTPA ion(-3) Cobalt(II) monoacetate ion(+1) Cobalt(II) acetate Cobalt(II) triacetate ion(-1) Cobalt(II) monoglycolate ion(-1) Cobalt(II) glycolate Cobalt(II) diglycine Cobalt(II) monoethylenediamine ion(+2) Cobalt(II) di(ethylenediamine) ion(+2) Cobalt tri(ethylenediamine) ion(+2)
Aspen HYSYSOLI Interface Name CLO3ION CLO4ION CNION CNOION CO COEL COIIC2O42ION COIIC2O43ION COIINH3ION COIINH32ION COIINH33ION COIINH34ION COIINH35ION COIINH36ION COIIINH36ION COIINO32 COIINO32.2H2O COIINO32.3H2O COIINO32.4H2O COIINO32.6H2O COIIOH2 COIIIOH3 COIIOH3ION COIIOH4ION COIISCN2 COIISECN2 COIIEDTAION COIIH2EDTA CODTPAION COACETION COACET2 COACET3ION COIIGLYCION COIIGLYC2 COGLYCIN2 COEDAION COEDA2ION COEDA3ION
A-61
A-62
Formula Co[C3H6NO2]+1 Co[C3H6NO2]2 Co[C4H4O6] Co[C6H15NO3]+2 Co[C6H5O7]-1 Co[C6H6NO6]-1 Co[C6H6NO6]2-4 Co[CAH4NO2]+1 Co[H2C14H18N3O10]1 Co[H2C6H5O7]+1 Co[H3C14H18N3O10] Co[HC10H12N2O8]-1 Co[HC14H18N3O10]-2 Co[HC6H5O7] Co[HC6H6NO6] Co[HCOO]+1 Co[HCOO]2 Co+2 Co+3 CO2 Co2[C14H18N3O10]-1 CO3-2 CoBr+1 CoBr2 CoBr2.2H2O CoBr2.4H2O CoBr2.6H2O CoC2O4 CoC2O4.2H2O CoCl+1 CoCl2 CoCl2.2H2O CoCl2.4H2O CoCl2.6H2O CoCl3 CoCO3 CoF2 CoF3
Common/IUPAC Name Cobalt(II) mono(L-alpha-alanine) ion(+1) Cobalt(II) di(L-alpha-alanine) Cobalt(II) tartrate Cobalt(II) monotriethanolamine ion(+2) Cobalt(II) citrate ion(-1) Cobalt(II) mono-NTA ion(-1) Cobalt(II) di-NTA ion(-4) Cobalt(II) monoglycine ion(+1) Cobalt(II) dihydrogen DTPA ion(-1) Cobalt(II) dihydrogen citrate ion(+1) Cobalt(II) trihydrogen DTPA Cobalt(II) hydrogen EDTA ion(-1) Cobalt(II) hydrogen DTPA ion(-2) Cobalt(II) monohydrogen citrate Cobalt(II) hydrogen NTA Cobalt(II) monoformate ion(+1) Cobalt(II) formate Cobalt ion(+2) Cobalt ion(+3) Carbon dioxide Dicobalt(II) DTPA ion(-1) Carbonate ion(-2) Cobalt(II) monobromide ion(+1) Cobalt(II) bromide Cobalt(II) bromide dihydrate Cobalt(II) bromide tetrahydrate Cobalt(II) bromide hexahydrate Cobalt(II) oxalate Cobalt(II) oxalate dihydrate Cobalt(II) monochloride ion(+1) Cobalt(II) chloride Cobalt(II) chloride dihydrate Cobalt(II) chloride tetrahydrate Cobalt(II) chloride hexahydrate Cobalt(III) chloride Cobalt(II) carbonate Cobalt(II) fluoride Cobalt(III) fluoride
Aspen HYSYSOLI Interface Name COIIALANION COIIALAN2 COIITRTRT COIITEXHION COIICTRTION COIINTAION COIINTA2ION COGLYCINION COH2DTPAION COIIH2CTRTION COH3DTPA COIIHEDTAION COHDTPAION COIIHCTRT COIIHNTA COCOOHION COCOOH2 COIIION COIIIION CO2 CO2DTPAION CO3ION COIIBRION COIIBR2 COIIBR2.2H2O COIIBR2.4H2O COIIBR2.6H2O COC2O4 COC2O4.2H2O COIICLION COIICL2 COIICL2.2H2O COIICL2.4H2O COIICL2.6H2O COIIICL3 COIICO3 COIIF2 COIIIF3 A-62
Formula CoMoO4 CoNO3+1 CoOH+1 CoOH+2 CoS COS CoSCN+1 CoSe CoSeCN+1 CoSeO3 CoSeO3.2H2O CoSeO4 CoSeO4.4H2O CoSeO4.6H2O CoSeO4.7H2O CoSeO4.H2O CoSO4 CoSO4.1H2O CoSO4.6H2O CoSO4.7H2O CoWO4 Cr Cr(C2O4)2-2 Cr(NO3)3 Cr(NO3)3.9H2O Cr(OH)2 Cr(OH)2+1 Cr(OH)3 Cr(OH)4-1 Cr[C10H12N2O8]-1 Cr[C10H12N2O8]-2 Cr[H2C10H12N2O8] Cr[HC10H12N2O8] Cr[HC10H12N2O8]-1 Cr+2 Cr+3 Cr2(SO4)3 Cr2(SO4)3
Common/IUPAC Name Cobalt(II) molybdate(VI) Cobalt(II) mononitrate ion(+1) Cobalt(II) monohydroxide ion(+1) Cobalt(III) monohydroxide ion(+2) Cobalt(II) sulfide Carbonyl sulfide Cobalt(II) monocyanide ion(+1) Cobalt(II) selenide Cobalt(II) selenocyanate ion(+1) Cobalt(II) selenite Cobalt(II) selenite dihydrate Cobalt(II) selenate Cobalt(II) selenate tetrahydrate Cobalt(II) selenate hexahydrate Cobalt(II) selenate heptahydrate Cobalt(II) selenate monohydrate Cobalt(II) sulfate Cobalt(II) sulfate monohydrate Cobalt(II) sulfate hexahydrate Cobalt(II) sulfate heptahydrate Cobalt(II) tungstate Chromium Chromium(II) dioxalate ion(-2) Chromium(III) nitrate Chromium(III) nitrate nonahydrate Chromium(II) hydroxide Chromium(III) dihydroxide ion(+1) Chromium (III) hydroxide Chromium(III) tetrahydroxide ion(-1) Chromium(III) EDTA ion(-1) Chromium(II) EDTA ion(-2) Chromium(II) dihydrogen EDTA Chromium(III) hydrogen EDTA Chromium(II) hydrogen EDTA ion(-1) Chromium ion(+2) Chromium ion(+3) Chromium(III) sulfate Chromium(III) sulfate
Aspen HYSYSOLI Interface Name COIIMOO4 COIINO3ION COIIOHION COIIIOHION COIIS COS COIISCNION COSE COIISECNION COSEO3 COSEO3.2H2O COSEO4 COSEO4.4H2O COSEO4.6H2O COSEO4.7H2O COSEO4.1H2O COIISO4 COIISO4.1H2O COIISO4.6H2O COIISO4.7H2O COWO4 CREL CRIIC2O42ION CRIIINO33 CRIIINO33.9H2O CRIIOH2 CROH2ION CROH3 CROH4ION CRIIIEDTAION CRIIEDTAION CRIIH2EDTA CRIIIHEDTA CRIIHEDTAION CRIIION CRIIIION CR2SO4 CR2SO43
A-63
A-64
Formula Cr2(SO4)3.14H2O Cr2(SO4)3.16H2O Cr2O7-2 Cr2S3 CrBr+2 CrBr2 CrBr3 CrC2O4 CrCl+2 CrCl2 CrCl2+1 CrCl3 CrF+2 CrF2 CrF3 CrH2PO4+2 CrHPO4+1 CrI+2 CrI2 CrI3 CrNO3+2 CrO3 CrO4-2 CrOH+2 CrS CrSO4+1 Cs Cs[B(C6H5)4] Cs[C2H3O2] Cs[C2H3O3] Cs[C2H3O3]2-1 Cs[C6H5O7]-2 Cs[H2C6H5O7] Cs[HCOO] Cs[HCOO].1H2O Cs+1 CS2
Common/IUPAC Name Chromium(III) sulfate tetradecahydrate Chromium(III) sulfate hexadecahydrate Dichromate(VI) ion(-2) Chromium(III) sulfide Chromium(III) monobromide ion(+2) Chromium(II) bromide Chromium(III) bromide Chromium(II) oxalate Chromium(III) monochloride ion(+2) Chromium(II) chloride Chromium(III) dichloride ion(+1) Chromium(III) chloride Chromium(III) monofluoride ion(+2) Chromium(II) Fluoride Chromium(III) fluoride Chromium(III) dihydrogen orthophosphate ion(+2) Chromium(III) hydrogen orthophosphate ion(+1) Chromium(III) monoiodide ion(+2) Chromium(II) iodide Chromium(III) iodide Chromium(III) mononitrate ion(+2) Chromium(VI) trioxide Chromate(VI) ion(-2) Chromium(III) monohydroxide ion(+2) Chromium(II) sulfide Chromium(III) sulfate ion(+1) Cesium Cesium tetraphenylborate Cesium acetate Cesium glycolate Cesium diglycolate ion(-1) Cesium citrate ion(-2) Cesium dihydrogen citrate Cesium formate Cesium formate monohydrate Cesium ion(+1) Carbon disulfide
Aspen HYSYSOLI Interface Name CR2SO4.14H2O CR2SO4.16H2O CR2O7ION CR2S3 CRIIIBRION CRIIBR2 CRIIIBR3 CRIIC2O4 CRIIICLION CRIICL2 CRIIICL2ION CRIIICL3 CRFION CRF2 CRF3 CRIIIH2PO4ION CRIIIHPO4ION CRIIIIION CRIII2 CRIIII3 CRIIINO3ION CRO3 CRO4ION CROHION CRS CRSO4ION CSEL CSBPH4 CSACET CSGLYCOL CSGLYCOL2ION CSCTRTION CSH2CTRT CSCOOH CSCOOH.1H2O CSION CRBDSULF
A-64
Formula Cs2CO3 Cs2CO3.3.5H2O Cs2CrO4 Cs2MoO4 Cs2SeO3 Cs2SeO4 Cs2SO4 CsBO2 CsBr CsCl CsF CsF.1H2O CsH2PO4 CsHF2 CsI CsNbO3 CsNO2 CsNO3 CsOH CsOH.H2O CsSO4-1 CsTaO3 CsTcO4 Cu Cu(C2O4)2-2 Cu(CN)2 Cu(CN)2-1 Cu(CN)3-2 Cu(CN)4-3 Cu(CO3)2-2 Cu(H2PO4)2 Cu(NH3)2+2 Cu(NH3)3+2 Cu(NH3)4+2 Cu(NH3)5+2 Cu(NO2)2 Cu(NO3)2 Cu(NO3)2.2.5H2O
Common/IUPAC Name Cesium carbonate Cesium carbonate 3.5 hydrate Cesium chromate(VI) Cesium molybdate(VI) Cesium selenite Cesium selenate Cesium sulfate Cesium metaborate Cesium bromide Cesium chloride Cesium fluoride Cesium fluoride monohydrate Cesium dihydrogen orthophosphate Cesium hydrogen difluoride Cesium iodide Cesium niobate Cesium nitrite Cesium nitrate Cesium hydroxide Cesium hydroxide monohydrate Cesium monosulfate ion(-1) Cesium tantalate Cesium pertechnetate Copper Copper(II) dioxalate ion(-2) Copper(II) cyanide Copper(I) dicyanide ion(-1) Copper(I) tricyanide ion(-2) Copper(I) tetracyanide ion(-3) Copper(II) dicarbonate ion(-2) Copper(II) dihydrogen orthophosphate Copper(II) diammonia ion(+2) Copper(II) triammonia ion(+2) Copper(II) tetraammonia ion(+2) Copper(II) pentaammonia ion(+2) Copper(II) nitrite Copper(II) nitrate Copper(II) nitrate 2.5 hydrate
Aspen HYSYSOLI Interface Name CS2CO3 CS2CO3.3.5H2O CS2CRO4 CS2MOO4 CS2SEO3 CS2SEO4 CS2SO4 CSBO2 CSBR CSCL CSF CSF.1H2O CSH2PO4 CSHF2 CSI CSNBO3 CSNO2 CSNO3 CSOH CSOH.1H2O CSSO4ION CSTAO3 CSTCVIIO4 CUEL CUC2O42ION CUCN2 CUICN2ION CUICN3ION CUICN4ION CUCO32ION CUH2PO42 CUNH32ION CUNH33ION CUNH34ION CUNH35ION CUNO22 CUNO32 CUNO32.2.5H2O
A-65
A-66
Formula Cu(OH)[C10H12N2O8]3 Cu(OH)[C6H6NO6]-2 Cu(OH)2 Cu(OH)3-1 Cu(OH)4-2 Cu(SCN)2 Cu(SCN)3-1 Cu(SCN)4-2 Cu[C10H12N2O8]-2 Cu[C14H18N3O10]-3 Cu[C2H3O2]+1 Cu[C2H3O2]2 Cu[C2H3O2]3-1 Cu[C2H3O3]+1 Cu[C2H3O3]2 Cu[C2H4NO2]+1 Cu[C2H4NO2]2 Cu[C2H7NO]+2 Cu[C2H7NO]2+2 Cu[C2H7NO]3+2 Cu[C2H7NO]4+2 Cu[C2H8N2]+2 Cu[C2H8N2]2+2 Cu[C3H6NO2]+1 Cu[C3H6NO2]2 Cu[C4H11NO2]+2 Cu[C4H11NO2]2+2 Cu[C4H11NO2]3+2 Cu[C4H11NO2]4+2 Cu[C4H4O6] Cu[C5H13NO2]+2
Common/IUPAC Name Copper(II) hydroxide EDTA ion(-3) Copper(II) hydroxide NTA ion(-2) Copper(II) hydroxide Copper(II) trihydroxide ion(-1) Copper(II) tetrahydroxide ion(-2) Copper(II) thiocyanate Copper(II) trithiocyanate ion(-1) Copper(II) tetrathiocyanate ion(-2) Copper(II) mono-EDTA ion(-2) Copper(II) DTPA ion(-3) Copper(II) monoacetate ion(+1) Copper(II) acetate Copper(II) triacetate ion(-1) Copper(II) monoglycolate ion(+1) Copper(II) glycolate Copper(II) monoglycine ion(+1) Copper(II) diglycine Copper(II) mono(2-aminoethanol) ion(+2) Copper(II) di(2-aminoethanol) ion(+2) Copper(II) tri(2-aminoethanol) ion(+2) Copper(II) tetra(2-aminoethanol) ion(+2) Copper(II) monoethylenediamine ion(+2) Copper(II) diethylenediamine ion(+2) Copper(II) mono(L-alpha-alanine) ion(+1) Copper(II) di(L-alpha-alanine) Copper(II) mono(N,N-diethanolamine) ion(+2) Copper(II) di(N.N-diethanolamine) ion(+2) Copper(II) tri(N,N-diethanolamine) ion(+2) Copper(II) tetra(N,N-diethanolamine) ion(+2) Copper(II) tartrate Copper(II) monodiethanolmethylamine ion(+2)
Aspen HYSYSOLI Interface Name CUOHEDTAION CUOHNTAION CUOH2 CUOH3ION CUOH4ION CUSCN2 CUSCN3ION CUSCN4ION CUEDTAION CUDTPAION CUACETION CUACET2 CUACET3ION CUGLYCOLION CUGLYCOL2 CUGLYCINION CUGLYCIN2 CUMEXHION CUMEXH2ION CUMEXH3ION CUMEXH4ION CUEDAION CUEDA2ION CUALANION CUALAN2 CUDEXHION CUDEXH2ION CUDEXH3ION CUDEXH4ION CUTRTRT CUMDEXHION
A-66
Formula Cu[C5H13NO2]2+2 Cu[C5H13NO2]3+2 Cu[C5H13NO2]4+2 Cu[C6H15NO3]+2 Cu[C6H15NO3]2+2 Cu[C6H5O7]-1 Cu[C6H6NO6]-1 Cu[C6H6NO6]2-4 Cu[H2C10H12N2O8] Cu[H2C14H18N3O10]1 Cu[H2C6H5O7]+1 Cu[H3C14H18N3O10] Cu[HC10H12N2O8]-1 Cu[HC14H18N3O10]-2 Cu[HC6H5O7] Cu[HC6H6NO6] Cu[HCOO]+1 Cu[HCOO]2 Cu+1 Cu+1 Cu+2 Cu2[C14H18N3010]-1 Cu2O Cu2S Cu2Se Cu3(PO4)2 Cu3(PO4)2.2H2O Cu3(PO4)2.3H2O CuBr CuBr+1 CuBr2 CuBr2.4H2O CuC2O4 CuCl CuCl2
Common/IUPAC Name Copper(II) di(diethanolmethylamine) ion(+2) Copper(II) tri(diethanolmethylamine) ion(+2) Copper(II) tetra(diethanolmethylamine) ion(+2) Copper(II) mono(triethanolamine) ion(+2) Copper(II) di(triethanolamine) ion(+2) Copper(II) citrate ion(-1) Copper(II) mono-NTA ion(-1) Copper(II) di-NTA ion(-4) Copper(II) dihydrogen EDTA Copper(II) dihydrogen DTPA ion(-1) Copper(II) dihydrogen citrate ion(+1) Copper(II) trihydrogen DTPA Copper(II) hydrogen EDTA ion(-1) Copper(II) hydrogen DTPA ion(-2) Copper(II) hydrogen citrate Copper(II) hydrogen NTA Copper(II) monoformate ion(+1) Copper(II) formate Copper(II) monochloride ion(+1) Copper ion(+1) Copper(II) ion(+2) Dicopper(II) DTPA ion(-1) Copper(I) oxide Copper(I) sulfide Copper(I) selenide Copper(II) phosphate Copper(II) orthophosphate dihydrate Copper(II) orthophosphate trihydrate Copper(I) bromide Copper(II) monobromide ion(+1) Copper(II) bromide Copper(II) bromide tetrahydrate Copper(II) oxalate Copper(I) chloride Copper(II) chloride
Aspen HYSYSOLI Interface Name CUMDEXH2ION CUMDEXH3ION CUMDEXH4ION CUTEXHION CUTEXH2ION CUCTRTION CUNTAION CUNTA2ION CUH2EDTA CUH2DTPAION CUH2CTRTION CUH3DTPA CUHEDTAION CUHDTPAION CUHCTRT CUHNTA CUCOOHION CUCOOH2 CUCLION CUIION CUION CU2DTPAION CU2O CUI2S CU2SE CU3PO42 CU3PO42.2H2O CU3PO42.3H2O CUIBR CUBRION CUBR2 CUBR2.4H2O CUC2O4 CUCL CUCL2
A-67
A-68
Formula CuCl2.2H2O CuCl3-1 CuCN CuCO3 CuF CuF2 CuI CuMoO4 CuNH3+2 CuNO2+1 CuNO3+1 CuNO32.6H2O CuOH CuOH+1 CuS CuSCN+1 CuSeO3 CuSeO3.2H2O CuSeO4 CuSeO4.5H2O CuSO4 CuSO4.3H2O CuSO4.5H2O CuWO4 Dy Dy(NO3)3 Dy(OH)[C6H6NO6]-1 Dy(OH)2+1 Dy(OH)3 Dy(OH)4-1 Dy(SO4)2-1 Dy[C10H12N2O8]-1 Dy[C14H18N3O10]-2 Dy[C2H3O2]+2 Dy[C2H3O2]2+1 Dy[C2H3O2]3 Dy[C4H4O6]+1 Dy[C6H5O7]
Common/IUPAC Name Copper(II) chloride dihydrate Copper(II) trichloride ion(-1) Copper(I) cyanide Copper(II) carbonate Copper(I) fluoride Copper(II) fluoride Copper(I) iodide Copper(II) molybdate Copper(II) monoammonia ion(+2) Copper(II) mononitrite ion(+1) Copper(II) mononitrate ion(+1) Copper(II) nitrate hexahydrate Copper(I) hydroxide Copper(II) monohydroxide ion(+1) Copper(II) sulfide Copper(II) monothiocyanate ion(+1) Copper(II) selenite Copper(II) selenite dihydrate Copper(II) selenate Copper(II) selenate pentahydrate Copper(II) sulfate Copper(II) sulfate trihydrate Copper(II) sulfate pentahydrate Copper(II) tungstate Dysprosium Dysprosium(III) nitrate Dysprosium(III) hydroxide NTA ion(-1) Dysprosium(III) dihydroxide ion(+1) Dysprosium(III) hydroxide Dysprosium(III) tetrahydroxide ion(-1) Dysprosium(III) disulfate ion(-1) Dysprosium(III) EDTA ion(-1) Dysprosium(III) DTPA ion(-2) Dysprosium(III) monoacetate ion(+2) Dysprosium(III) diacetate ion(+1) Dysprosium(III) acetate Dysprosium(III) tartrate ion(+1) Dysprosium(III) citrate
Aspen HYSYSOLI Interface Name CUCL2.2H2O CUCL3ION CUICN CUCO3 CUF CUF2 CUII CUMOO4 CUNH3ION CUNO2ION CUNO3ION CUNO32.6H2O CUIOH CUOHION CUS CUSCNION CUSEO3 CUSEO3.2H2O CUSEO4 CUSEO4.5H2O CUSO4 CUSO4.3H2O CUSO4.5H2O CUWO4 DYEL DYNO33 DYOHNTAION DYOH2ION DYOH3 DYOH4ION DYSO42ION DYEDTAION DYDTPAION DYACETION DYACET2ION DYACET3 DYTRTRTION DYCTRT
A-68
Formula Dy[C6H6NO6] Dy[C6H6NO6]2-3 Dy[H2C14H18N3O10] Dy[HC10H12N2O8] Dy[HC10H18N3O10]-1 Dy+3 Dy2(CO3)3 Dy2(SO4)3 Dy2(SO4)3.8H2O Dy2[C4H4O6]3 DyCl+1 DyCl+2 DyCl3 DyCl4-1 DyCO3+1 DyF+2 DyF2+1 DyF3 DyF4-1 DyH2PO4+2 DyHCO3+2 DyNO3+2 DyOH+2 DyPO4 DySO4+1 Er Er(NO3)3 Er(OH)[C6H6NO6]-1 Er(OH)2+1 Er(OH)3 Er(OH)4-1 Er(SO4)2-1 Er[C10H12N2O8]-1 Er[C14H18N3O10]-1 Er[C14H18N3O10]-2 Er[C2H3O2]+2 Er[C2H3O2]2+1 Er[C2H3O2]3
Common/IUPAC Name Dysprosium(III) NTA Dysprosium(III) di-NTA ion(-3) Dysprosium(III) dihydrogen DTPA Dysprosium(III) hydrogen EDTA Dysprosium(III) hydrogen DTPA ion(-1) Dysprosium ion(+3) Dysprosium(III) carbonate Dysprosium(III) sulfate Dysprosium(III) sulfate octahydrate Dysprosium(III) tartrate Dysprosium(III) dichloride ion(+1) Dysprosium(III) monochloride ion(+2) Dysprosium(III) chloride Dysprosium(III) tetrachloride ion(-1) Dysprosium(III) carbonate ion(+1) Dysprosium(III) monofluoride ion(+2) Dysprosium(III) difluoride ion(+1) Dysprosium(III) fluoride Dysprosium(III) tetrafluoride ion(-1) Dysprosium(III) dihydrogen orthophosphate ion(+2) Dysprosium(III) bicarbonate ion(+2) Dysprosium(III) mononitrate ion(+2) Dysprosium(III) monohydroxide ion(+2) Dysprosium(III) orthophosphate Dysprosium(III) monosulfate ion(+1) Erbium Erbium(III) nitrate Erbium(III) hydroxide NTA ion(-1) Erbium(III) dihydroxide ion(+1) Erbium(III) hydroxide Erbium(III) tetrahydroxide ion(-1) Erbium(III) disulfate ion(-1) Erbium(III) EDTA ion(-1) Erbium(III) hydrogen DTPA ion(-1) Erbium(III) DTPA ion(-2) Erbium(III) monoacetate ion(+2) Erbium(III) diacetate ion(+1) Erbium(III) acetate
Aspen HYSYSOLI Interface Name DYNTA DYNTA2ION DYH2DTPA DYHEDTA DYHDTPAION DYION DY2CO33 DY2SO43 DY2SO43.8H2O DY2TRTRT3 DYCL2ION DYCLION DYCL3 DYCL4ION DYCO3ION DYFION DYF2ION DYF3 DYF4ION DYH2PO4ION DYHCO3ION DYNO3ION DYOHION DYPO4 DYSO4ION EREL ERNO33 EROHNTAION EROH2ION EROH3 EROH4ION ERSO42ION EREDTAION ERHDTPAION ERDTPAION ERACETION ERACET2ION ERACET3 A-69
A-70
Formula Er[C4H4O6]+1 Er[C6H5O7] Er[C6H6NO6] Er[C6H6NO6]2-3 Er[H2C14H18N3O10] Er[HC10H12N2O8] Er+3 Er2(CO3)3 Er2(SO4)3 Er2(SO4)3.8H2O Er2[C4H4O6]3 ErCl+2 ErCl2+1 ErCl3 ErCL3.6H2O ErCl4-1 ErCO3+1 ErF+2 ErF2+1 ErF3 ErF4-1 ErH2PO4+2 ErHCO3+2 ErNO3+2 ErOH+2 ErPO4 ErSO4+1 Eu Eu(NO3)3 Eu(OH)[C6H6NO6]-1 Eu(OH)2 Eu(OH)2+1 Eu(OH)3 Eu(OH)4-1 Eu(SO4)2-1 Eu[C10H12N2O8]-1 Eu[C14H18N3O10]-2 Eu[C2H2O3]+2
Common/IUPAC Name Erbium(III) tartrate ion(+1) Erbium(III) citrate Erbium(III) NTA Erbium(III) di-NTA ion(-3) Erbium(III) dihydrogen DTPA Erbium(III) hydrogen EDTA Erbium ion (+3) Erbium(III) carbonate Erbium(III) sulfate Erbium(III) sulfate octahydrate Erbium(III) tartrate Erbium(III) monochloride ion(+2) Erbium(III) dichloride ion(+1) Erbium(III) chloride Erbium(III) chloride hexahydrate Erbium(III) tetrachloride ion(-1) Erbium(III) monocarbonate ion(+1) Erbium(III) monofluoride ion(+2) Erbium(III) difluoride ion(+1) Erbium(III) fluoride Erbium(III) tetrafluoride ion(-1) Erbium(III) dihydrogen orthophosphate ion(+2) Erbium(III) bicarbonate ion(+2) Erbium(III) mononitrate ion(+2) Erbium(III) monohydroxide ion(+2) Erbium(III) orthophosphate Erbium(III) monosulfate ion(+1) Europium Europium(III) nitrate Europium(III) hydroxide NTA ion(-1) Europium(II) hydroxide Europium(III) dihydroxide ion(+1) Europium(III) hydroxide Europium(III) tetrahydroxide ion(-1) Europium(III) disulfate ion(-1) Europium(III) EDTA ion(-1) Europium(III) DTPA ion(-2) Europium(III) monoacetate ion(+2)
Aspen HYSYSOLI Interface Name ERTRTRTION ERCTRT ERNTA ERNTA2ION ERH2DTPA ERHEDTA ERION ER2CO33 ER2SO43 ER2SO43.8H2O ER2TRTRT3 ERCLION ERCL2ION ERCL3 ERCL3.6H2O ERCL4ION ERCO3ION ERFION ERF2ION ERF3 ERF4ION ERH2PO4ION ERHCO3ION ERNO3ION EROHION ERPO4 ERSO4ION EUEL EUNO33 EUOHNTAION EUIIOH EUOH2ION EUOH3 EUOH4ION EUSO42ION EUEDTAION EUDTPAION EUACETION A-70
Formula Eu[C2H3O2]2+1 Eu[C2H3O2]3 Eu[C2O4]+1 Eu[C2O4]2-1 Eu[C3H6NO2]+1 Eu[C3H6NO2]2 Eu[C4H4O6]+1 Eu[C6H5O7] Eu[C6H6NO6] Eu[C6H6NO6]2-3 Eu[CHO2]+1 Eu[CHO2]+2 Eu[CHO2]2 Eu[CHO2]2+1 Eu[CHO2]3 Eu[H2C14H18N3O10] Eu[HC10H12N2O8] Eu[HC14H18N3O10]-1 Eu+2 Eu+3 Eu2(CO3)3 Eu2(SO4)3 Eu2(SO4)3.8H2O Eu2[C2O4]3 Eu2[C4H4O603 EuBr+2 EuBr3 EuCl+1 EuCl+2 EuCl2 EuCl2+1 EuCl3 EuCL3.6H2O EuCL3-1 EuCl4-1 EuCl4-2 EuCO3+1 EuF+1
Common/IUPAC Name Europium(III) diacetate ion(+1) Europium(III) acetate Europium(III) monooxalate(+1) Europium(III) dioxalate ion(-1) Europium(II) mono(L-alpha-alanine) ion(+1) Europium(II) di(L-alpha-alanine) Europium(III) monotartrate ion(+1) Europium(III) citrate Europium(III) NTA Europium(III) di-NTA ion(-3) Europium(II) monoformate ion(+1) Europium(III) monoformate ion(+2) Europium(II) formate Europium(III) diformate ion(+1) Europium(III) formate Europium(III) dihydrogen DTPA Europium(III) hydrogen EDTA Europium(III) hydrogen DTPA ion(-1) Europium ion(+2) Europium ion(+3) Europium(III) carbonate Europium(III) sulfate Europium(III) sulfate octahydrate Europium(III) oxalate Europium(III) tartrate Europium(III) monobromide ion(+2) Europium(III) bromide Europium(II) monochloride ion(+1) Europim(III) monochloride ion(+2) Europium(II) chloride Europium(III) dichloride ion(+1) Europium(III) chloride Europium(III) chloride hexahydrate Europium(II) trichloride ion(-1) Europium(III) tetrachloride ion(-1) Europium(II) tetrachloride ion(-2) Europium(III) monocarbonate ion(+1) Europium(II) monofluoride ion(+1)
Aspen HYSYSOLI Interface Name EUACET2ION EUACET3 EUC2O4ION EUC2O42ION EUIIALANION EUIIALAN2 EUTRTRTION EUCTRT EUNTA EUNTA2ION EUIIFORION EUFORION EUIIFOR2 EUFOR2ION EUFOR3 EUH2DTPA EUHEDTA EUHDTPAION EUIIION EUIIIION EU2CO33 EU2SO43 EU2SO43.8H2O EU2C2O43 EU2TRTRT3 EUBRION EUBR3 EUIICLION EUCLION EUIICL2 EUCL2ION EUCL3 EUCL3.6H2O EUIICL3ION EUCL4ION EUIICL4ION EUCO3ION EUIIFION A-71
A-72
Formula EuF+2 EuF2 EuF2+1 EuF3 EuF3-1 EuF4-1 EuF4-2 EuH2PO4+2 EuHCO3+2 EuNO3+2 EuOH+2 EuPO4 EuSO4+1 F-1 F2 Fe Fe(C2O4)2-1 Fe(C2O4)2-2 Fe(C2O4)3-3 Fe(C2O4)3-4 Fe(CN)6-3 Fe(CN)6-4 Fe(HAsO4)+1 Fe(NO3)2 Fe(NO3)2.6H2O Fe(NO3)3 Fe(NO3)3.9H2O Fe(OH)2 Fe(OH)2+1 Fe(OH)3 Fe(OH)3-1 Fe(OH)4-1 Fe(OH)4-2 Fe(SCN)2+1 Fe(SCN)3 Fe[C10H12N2O8]-1
Common/IUPAC Name Europium(III) fluoride ion(+2) Europium(II) fluoride Europium(III) difluoride ion(+1) Europium(III) fluoride Europium(II) trifluoride ion(-1) Europium(III) tetrafluoride ion(-1) Europium(II) tetrafluoride ion(-2) Europium(III) dihydrogen orthophosphate ion(+2) Europium(III) hydrogen carbonate ion(+2) Europium(III) mononitrate ion(+2) Europium(III) monohydroxide ion(+2) Europium(III) orthophosphate Europium(III) monosulfate ion(+1) Fluoride ion (-1) Fluorine Iron Iron(III) dioxalate ion(-1) Iron(II) dioxalate ion(-2) Iron(III) trioxalate ion(-3) Iron(II) trioxalate ion(-4) Iron(III) hexacyanide ion(-3) Iron(II) hexacyanide ion(-4) Iron(III) monohydrogen orthoarsenate ion(+1) Iron(II) nitrate Iron(II) nitrate hexahydrate Iron(III) nitrate Iron(III) nitrate nonahydrate Iron(II) hydroxide Iron(III) dihydroxide ion(+1) Iron(III) hydroxide Iron(II) trihydroxide ion(-1) Iron(III) tetrahydroxide ion(-1) Iron(II) tetrahydroxide ion(-2) Iron(III) dithiocyanate ion(+1) Iron(III) thiocyanate Iron(III) EDTA ion(-1)
Aspen HYSYSOLI Interface Name EUFION EUIIF2 EUF2ION EUF3 EUIIF3ION EUF4ION EUIIF4ION EUH2PO4ION EUHCO3ION EUNO3ION EUOHION EUPO4 EUSO4ION FION F2 FEEL FEIIIC2O42ION FEIIC2O42ION FEIIIC2O43ION FEIIC2O43ION FEIIICN6ION FEIICN6ION FEIIIHASO4ION FEIINO32 FEIINO32.6H2O FEIIINO33 FEIIINO33.9H2O FEIIOH2 FEIIIOH2ION FEIIIOH3 FEIIOH3ION FEIIIOH4ION FEIIOH4ION FEIIISCN2ION FEIIISCN3 FEIIIEDTAION
A-72
Formula Fe[C10H12N2O8]-2 Fe[C10H14N2O8] Fe[C14H18N3O10]-2 Fe[C14H18N3O10]-3 Fe[C2H3O2]+1 Fe[C2H3O2]2 Fe[C2H3O3]+1 Fe[C2H3O3]+2 Fe[C2H3O3]2 Fe[C2H4NO2]+1 Fe[C2H4NO2]2 Fe[C3H6NO2]+1 Fe[C3H6NO2]2 Fe[C4H4O6] Fe[C4H4O6]+1 Fe[C4H4O6]3 Fe[C6H5O7] Fe[C6H5O7]-1 Fe[C6H6NO6] Fe[C6H6NO6]-1 Fe[C6H6NO6]2-3 Fe[H2C14H18N3O10] Fe[H3C14H18N3O10] Fe[HC10H12N2O8] Fe[HC10H12N2O8]-1 Fe[HC14H18N3O10]-1 Fe[HC14H18N3O10]-2 Fe[HC6H5O7] Fe[HC6H6NO6] Fe[HCOO]+1 Fe[HCOO]2 Fe[NO][C10H12N2O8]2 Fe+2 Fe+3 Fe1.11Te Fe2(C2O4)3 Fe2(OH)2+4 Fe2(SO4)3
Common/IUPAC Name Iron(II) EDTA ion(-2) Iron(II) dihydrogen EDTA Iron(III) DTPA ion(-2) Iron(II) DTPA ion(-3) Iron(II) monoacetate ion(+1) Iron(II) acetate Iron(II) monoglycolate ion(+1) Iron(III) glycolate ion(+2) Iron(II) glycolate Iron(II) monoglycinate ion(+1) Iron(II) glycinate Iron(II) mono(L-alpha-alanine) ion(+1) Iron(II) di(L-alpha-alanine) Iron(II) tartrate Iron(III) tartrate ion(+1) Iron(III) tartrate Iron(III) citrate Iron(II) citrate ion(-1) Iron(III) NTA Iron(II) NTA ion(-1) Iron(III) di-NTA ion(-3) Iron(III) dihydrogen DTPA Iron(II) trihydrogen DTPA Iron(III) hydrogen EDTA Iron(II) hydrogen EDTA ion(-1) Iron(III) hydrogen DTPA ion(-1) Iron(II) hydrogen DTPA ion(-2) Iron(II) hydrogen citrate Iron(II) hydrogen NTA Iron(II) monoformate ion(+1) Iron(II) formate Iron(II) nitrogen monoxide EDTA ion(-2) Iron ion(+2) Iron ion(+3) Iron(II) telluride Iron(III) oxalate Diiron(III) dihydroxide ion(+4) Iron(III) sulfate
Aspen HYSYSOLI Interface Name FEIIEDTAION FEIIH2EDTA FEDTPAION FEIIDTPAION FEACETION FEACET2 FEIIGLYCION FEIIIGLYCOION FEIIGLYC2 FEGLYCINION FEGLYCIN2 FEIIALANION FEIIALAN2 FEIITRTRT FEIIITRTRTION FE2TARTRT3 FEIIICTRT FEIICTRTION FENTA FEIINTAION FENTA2ION FEH2DTPA FEIIH3DTPA FEIIIHEDTA FEIIHEDTAION FEHDTPAION FEIIHDTPAION FEIIHCTRT FEIIHNTA FECOOHION FECOOH2 FEIINOEDTAION FEIIION FEIIIION FETE FEIII2C2O43 FEIII2OH2ION FE2SO43 A-73
A-74
Formula Fe2[C14H18N3O10]-1 Fe2Al2SiO5(OH)4 Fe2Al9Si4O23(OH) Fe2Fe(FeSiO5)(OH)4 Fe3(PO4)2 Fe3(PO4)2.8H2O Fe3Al2Si3O12 Fe3Si2O5(OH)4 Fe3Si4O10(OH)2 Fe4[Fe(CN)6]3 Fe5Al2Si3O10(OH)8 Fe7Si8O22(OH)2 FeAl2SiO5(OH)2 FeAsO4 FeAsO4 FeAsO4.2H2O FeBr+2 FeBr2 FeBr2.2H2O FeBr2.4H2O FeBr2.6H2O FeBr3 FeC2O4 FeC2O4+1 FeCl+1 FeCl2 FeCl2.2H2O FeCl2.4H2O FeCl2.6H2O FeCl2+1 FeCl2+2 FeCl3 FeCl3.2.5H2O FeCl3.2H2O FeCl3.6H2O
Common/IUPAC Name Diiron(II) DTPA ion(-1) Dialuminum diiron silicon pentaoxide tetrahydroxide Diiron nonaaluminum tetrasilicon tricosaoxide hydroxide Tetrairon silicon petaoxide tetrahydroxide Iron(II) orthophosphate Iron(II) orthophosphate octahydrate Almandine Triiron disilicon pentaoxide tetrahydroxide Triiron tetrasilicon decaoxide dihydroxide Iron(III) hexacyanoferrate(II) Pentairon dialuminum trisilicon decaoxide octahydroxide Heptairon octasilicon docosaoxide dihydroxide Dialuminum iron silicon pentoxide dihydroxide Iron(III) Arsenate Iron(III) Arsenate Iron(III) Arsenate dihydrate Iron(III) monobromide ion(+2) Iron(II) bromide Iron(II) bromide dihydrate Iron(II) bromide tetrahydrate Iron(II) bromide hexahydrate Iron(III) bromide Iron(II) oxalate Iron(III) monooxalate ion(+1) Iron(II) monochloride ion(+1) Iron(II) chloride Iron(II) chloride dihydrate Iron(II) chloride tetrahydrate Iron(II) chloride hexahydrate Iron(III) dichloride ion(+1) Iron(III) monochloride ion(+2) Iron (III) chloride Iron(III) chloride 2.5 hydrate Iron(III) chloride dihydrate Iron(III) chloride hexahydrate
Aspen HYSYSOLI Interface Name FEII2DTPAION CHAMOSITE7A STAUROLITE CRONS7A FEII3PO42 FEII3PO42.8H2O ALMANDINE GREENALITE MINESOTAIT FE4FECN63 DAPHNIT14A GRUNERITE CHLORITOID FEIIIARSO4 FEARSO4 FEARSO4.2H2O FEIIIBRION FEIIBR2 FEIIBR2.2H2O FEIIBR2.4H2O FEIIBR2.6H2O FEIIIBR3 FEIIC2O4 FEIIIC2O4ION FEIICLION FEIICL2 FEIICL2.2H2O FEIICL2.4H2O FEIICL2.6H2O FEIIICL2ION FEIIICLION FECL3 FECL3.2.5H2O FECL3.2H2O FECL3.6H2O
A-74
Formula FeCl4-1 FeCO3 FeF+2 FeF2 FeF2+1 FeF3 FeH2PO4+1 FeH2PO4+2 FeHC2O4+2 FeHCO3+1 FeHPO4 FeHPO4+1 FeI+2 FeI2 FeI2+1 FeI3 FeMoO4 FeNaSi2O6 FeNO3+2 FeOH+1 FeOH+2 FePO4 FePO4.2H2O FeS FeS2 FeSCN+2 FeSO3 FeSO4 FeSO4.1H2O FeSO4.4H2O FeSO4.7H2O FeSO4+1 FeTiO3 FeWO4 Ga Ga(OH)3
Common/IUPAC Name Iron(III) tetrachloride ion(-1) Iron(II) carbonate Iron(III) monofluoride ion(+2) Iron(II) fluoride Iron(III) difluoride ion(+1) Iron(III) fluoride Iron(II) dihydrogen orthophosphate ion(+1) Iron(III) dihydrogen orthophosphate ion(+2) Iron(III) hydrogen oxalate ion(+2) Iron(II) bicarbonate ion(+1) Iron(II) hydrogen orthophosphate Iron(III) hydrogen orthophosphate ion(+1) Iron(III) monoiodide ion(+2) Iron(II) iodide Iron(III) diiodide ion(+1) Iron(III) iodide Iron(II) molybdate(VI) Iron(III) sodium silicate Iron(III) mononitrate ion(+2) Iron(II) monohydroxide ion(+1) Iron(III) monohydroxide ion(+2) Iron(III) orthophosphate Iron(III) phosphate dihydrate Iron(II) sulfide Iron(II) disulfide Iron(III) monothiocyanate ion(+2) Iron(II) sulfite Iron(II) sulfate Iron(II) sulfate monohydrate Iron(II) sulfate tetrahydrate Iron(II) sulfate heptahydrate Iron(III) sulfate ion(+1) Iron(II) titanate Iron(II) tungstate(VI) Gallium Gallium hydroxide
Aspen HYSYSOLI Interface Name FEIIICL4ION FEIICO3 FEIIIFION FEIIF2 FEIIIF2ION FEIIIF3 FEIIH2PO4ION FEIIIH2PO4ION FEIIIHC2O4ION FEIIHCO3ION FEIIHPO4 FEIIIHPO4ION FEIIIIION FEIII2 FEIIII2ION FEIIII3 FEMOO4 NAFEIIISIO FEIIINO3ION FEIIOHION FEIIIOHION FEIIIPO4 FEIIIPO4.2H2O FEIIS FEIIS2 FEIIISCNION FEIISO3 FEIISO4 FEIISO4.1H2O FEIISO4.4H2O FEIISO4.7H2O FEIIISO4ION FETIO3 FEIIWO4 GAEL GAOH3
A-75
A-76
Formula Ga+3 Gd Gd(NO3)3.6H2O Gd(OH)[C6H6NO6]-1 Gd(OH)2+1 Gd(OH)3 Gd(OH)4-1 Gd(SO4)2-1 Gd[C10H12N2O8]-1 Gd[C14H18N3O10]-2 Gd[C2H3O2]+2 Gd[C2H3O2]2+1 Gd[C2H3O2]3 Gd[C4H4O6]+1 Gd[C6H5O7] Gd[C6H6NO6] GD[C6H6NO6]2-3 Gd[CHO2]+2 Gd[CHO2]2+1 Gd[CHO2]3 Gd[H2C14H18N3O10] Gd[HC10H12N2O8] Gd[HC14H18N3O10]-1 Gd+3 Gd2(CO3)3 Gd2(SO4)3 Gd2(SO4)3.8H2O Gd2[C4H4O6]3 Gd9NO3)3 GdBr+2 GdBr3 GdCl+2 GdCl2+1 GdCl3 GdCl4-1 GdCO3+1 GdF+2 GdF2+1
Common/IUPAC Name Gallium ion(+3) Gadolinium Gadolinium(III) nitrate hexahydrate Gadolinium(III) monohydroxide NTA ion(1) Gadolinium(III) dihydroxide ion(+1) Gadolinium(III) hydroxide Gadolinium(III) tetrahydroxide ion(-1) Gadolinium(III) disulfate ion(-1) Gadolinium(III) EDTA ion(-1) Gadolinium(III) DTPA ion(-2) Gadolinium(III) monoacetate ion(+2) Gadolinium(III) diacetate ion(+1) Gadolinium(III) acetate Gadolinium(III) tartrate ion(+1) Gadolinium(III) citrate Gadolinium(III) NTA Gadolinium(III) di-NTA ion(-3) Gadolinium(III) monoformate ion(+2) Gadolinium(III) diformate ion(+1) Gadolinium(III) formate Gadolinium(III) dihydrogen DTPA Gadolinium(III) hydrogen EDTA Gadolinium(III) hydrogen DTPA ion(-1) Gadolium ion(+3) Gadolinium(III) carbonate Gadolinium(III) sulfate Gadolinium(III) sulfate octahydrate Gadolinium(III) tartrate Gadolinium(III) nitrate Gadolinium(III) monobromide ion(+2) Gadolinium(III) bromide Gadolinium(III) monochloride ion(+2) Gadolinium(III) dichloride ion(+1) Gadolinium(III) chloride Gadolinium(III) tetrachloride ion(-1) Gadolinium(III) carbonate ion(+1) Gadolinium(III) monofluoride ion(+2) Gadolinium(III) difluoride ion(+1)
Aspen HYSYSOLI Interface Name GAION GDEL GDNO33.6H2O GDOHNTAION GDOH2ION GDOH3 GDOH4ION GDSO42ION GDEDTAION GDDTPAION GDACETION GDACET2ION GDACET3 GDTRTRTION GDCTRT GDNTA GDNTA2ION GDFORION GDFOR2ION GDFOR3 GDH2DTPA GDHEDTA GDHDTPAION GDION GD2CO33 GD2SO43 GD2SO43.8H2O GD2TRTRT3 GDNO33 GDBRION GDBR3 GDCLION GDCL2ION GDCL3 GDCL4ION GDCO3ION GDFION GDF2ION A-76
Formula GdF3 GdF4-1 GdH2PO4+2 GdHCO3+2 GdI+2 GdI3 GdNO3+2 GdOH+2 GdPO4 GdSO4+1 Ge H[B(C6H5)4] H[C14H18N3O10]-4 H[C6H6NO6]-2 H[Fe(CN)6]-3 H+1 H2 H2[C14H18N3O10]-3 H2[C6H6NO6]-1 H2[Fe(CN)6]-2 H2As2S3O H2AsO4-1 H2C10H12N2O8-2 H2C2H8N2+2 H2CO3 H2CrO4 H2CrO7 H2MnO4 H2MoO4 H2N(CH2)4CH(NH2)CO 2H H2N(CH2)4CH(NH2)CO 2H-1 H2N(CH2)4CH(NH3)CO 2H+1 H2O H2O2 H2P2O7-2
Common/IUPAC Name Gadolinium(III) fluoride Gadolinium(III) tetrafluoride ion(-1) Gadolinium(III) dihydrogen orthophosphate ion(+2) Gadolinium(III) bicarbonate ion(+2) Gadolinium(III) monoiodide ion(+2) Gadolinium(III) iodide Gadolinium(III) mononitrate ion(+2) Gadolinium(III) monohydroxide ion(+2) Gadolinium(III) orthophosphate Gadolinium(III) monosulfate ion(+1) Germanium Hydrogen tetraphenylborate Hydrogen DTPA ion(-4) Hydrogen NTA ion(-2) Hydrogen ferrocyanide(II) ion(-3) Hydrogen ion(+1) Hydrogen Dihydrogen DTPA ion(-3) Dihydrogen NTA ion(-1) Dihydrogen ferrocyanide ion(-2) Arsenic(III) sulfide oxide Dihydrogen arsenate(VI) ion(-1) Dihydrogen EDTA ion(-2) Dihydrogen ethylenediamine ion(+2) Carbonic acid Chromic(VI) acid Dichromic(VI) acid Manganic(VI) acid Molybdenic(VI) acid Lysine Lysine ion(-1) Dihydrogen lysine ion(+1) Water HYDROGEN PEROXIDE Dihydrogen pyrophosphate(V) ion(-2)
Aspen HYSYSOLI Interface Name GDF3 GDF4ION GDH2PO4ION GDHCO3ION GDIION GDI3 GDNO3ION GDOHION GDPO4 GDSO4ION GEEL HBPH4 HDTPAION HNTAION HFEIICN6ION HION H2 H2DTPAION H2NTAION H2FEIICN6ION H2AS2S3O H2ASO4ION H2EDTAION H2ENAMN2ION H2CO3 H2CRO4 H2CR2O7 H2MNO4 H2MOO4 HLYSINE LYSINEION H2LYSINEION H2O H2O2 H2P2O7ION
A-77
A-78
Formula H2PO3-1 H2PO4-1 H2S H2S2 H2S2O3 H2S2O4 H2S2O6 H2S2O8 H2S5O6 H2Se H2SeO3 H2SeO4 H2SiF6 H2SiO4-2 H2SO3 H2SO4 H2SO5 H2Te H2TeO3 H2TeO4 H2TeO4.2H2O H2TeO4.6H2O H2VO4-1 H2WO4 H2ZrF6 H3[C14H18N3O10]-2 H3[Fe(CN)6] H3AsO3 H3AsO4 H3C10H12N2O8-1 H3IO6-2 H3N(CH2)4CH(NH3)CO 2H+2 H3P2O7-1 H3PO3 H3PO4 H3SiO4-1 H4[C14H18N3O10]-1 H4[C6H6NO6]+1
Common/IUPAC Name Dihydrogen phosphate(III) ion(-1) Dihydrogen orthophosphate(V) ion(-1) Hydrogen sulfide Dihydrogen disulfide Thiosulfuric acid Dithionous acid Dithionic acid Peroxodisulfuric(VII) acid Pentathionic acid Dihydrogen selenide Selenious(IV) acid Selenic(VI) acid Dihydrogen hexafluorosilicate Dihydrogen orthosilicate ion(-2) Sulfurous(IV) acid Sulfuric(VI) acid Peroxomonosulfuric(VIII) acid Hydrogen telluride Tellurous(IV) acid Telluric(VI) acid Telluric(VI) acid dihydrate Telluric(VI) acid hexahydrate Dihydrogen orthovanadate(V) ion(-1) Tungstic(VI) acid Hexafluorozirconic acid Trihydrogen DTPA ion(-2) Trihydrogen hexaferricyanide Arsenious acid Arsenic(VI) acid Trihydrogen EDTA ion(-1) Trihydrogen orthoperiodate ion(-2) Trihydrogen lysine ion(+2) Trihydrogen pyrophosphate(V) ion(-1) Phosphorous(III) acid Orthophosphoric acid Trihydrogen silicate ion(-1) Tetrahydrogen DTPA ion(-1) Tetrahydrogen NTA ion(+1)
Aspen HYSYSOLI Interface Name H2PO3ION H2PO4ION H2S H2S2 H2S2O3 H2S2O4 H2S2O6 H2S2O8 H2S5O6 SEH2 H2SEO3 H2SEO4 H2SIF6 H2SIO4ION H2SO3 H2SO4 H2SO5 H2TE H2TEIVO3 H2TEO4 H2TEO4.2H2O H2TEO4.6H2O H2VO4ION H2WO4 H2ZRF6 H3DTPAION H3FEIIICN6 H3ASO3 H3ASO4 H3EDTAION H3IO6ION H3LYSINEION H3P2O7ION H3PO3 H3PO4 H3SIO4ION H4DTPAION H4NTAION A-78
Formula H4[Fe(CN)6] H4C10H12N2O8 H4IO6-1 H4O4Pt H4P2O7 H4SiO4 H4TeO6-2 H5C10H12N2O8+1 H5C14H18N3O10 H5IO6 H5TeO6-1 H6C10H12N2O8+2 H6TeO6 HAs2S4-1 HAsO2 HAsO3-2 HAsO4-2 HBr HBr3 HBrO HBrO3 HBrO4 HC10H12N2O8-3 HC2H8N2+1 HCl HClO HClO2 HClO3 HClO4 HCN HCNO HCO3-1 HCrO4-1 He HF Hf HF2-1 Hg
Common/IUPAC Name Tetrahydrogen ferrocyanide(II) EDTA Tetrahydrogen orthoperiodate(VII) ion(1) Pyrophosphoric(VI) acid Silicic acid Tetrahydrogen orthotellurate ion(-2) Pentahydrogen EDTA ion(+1) DTPA Periodic(VII) acid Pentahydrogen orthotelluric acid ion(-1) Hexahydrogen EDTA ion(+2) Orthotelluric acid Hydrogen diarsenic(III) tetrasulfide ion Metaarsenic(III) acid Biarsenate ion(-2) Hydrogen arsenate(VI) ion(-2) Hydrogen bromide Hydrogen tribromide Hypobromic(I) acid Bromic(VI) acid Perbromic(VII) acid Hydrogen EDTA ion(-3) Hydrogen ethylenediamine ion(+1) Hydrogen chloride Hypochlorous acid Chlorous(III) acid Chloric(VI) acid Perchloric acid Hydrocyanic acid Cyanic acid Bicarbonate ion(-1) Bichromate(VI) ion(-1) Helium Hydrogen fluoride Hafnium Hydrogen difluoride ion (-1) Mercury
Aspen HYSYSOLI Interface Name H4FEIICN6 H4EDTA H4IO6ION PTOH4 H4P2O7 H4SIO4 H4TEO6ION H5EDTAION H5DTPA H5IO6 H5TEO6ION H6EDTAION H6TEO6 HAS2S4ION HASO2 HARSO3ION HASO4ION HBR HBR3 HBRO HBRO3 HBRO4 HEDTAION HENAMN2ION HCL HCLO HCLO2 HCLO3 HCLO4 HCN HCNO HCO3ION HCRO4ION HE HF HFEL HF2ION HGEL A-79
A-80
Formula Hg(CN)2 Hg(CN)3-1 Hg(CN)4-2 Hg(NH3)2+2 Hg(NH3)3+2 Hg(NH3)4+2 Hg(OH)[C2H8N2]+1 Hg(OH)2 Hg(OH)3-1 Hg(SCN)2 Hg(SCN)3-1 Hg(SCN)4-2 Hg[C10H12N2O8]-2 Hg[C14H18N3O10]-3 Hg[C2H3O2]+1 Hg[C2H3O2]2 Hg[C2H3O2]3-1 Hg[C2H3O3]+1 Hg[C2H3O3]2 Hg[C2H4NO2]+1 Hg[C2H4NO2]2 Hg[C2H7NO]+2 Hg[C2H7NO]2+2 Hg[C2H8N2]+2 Hg[C2H8N2]2+2 Hg[C4H11NO2]+2 Hg[C4H11NO2]2+2 Hg[C4H4O6] Hg[C6H15NO3]+2 Hg[C6H15NO3]2+2 Hg[C6H5O7]-1 Hg[C6H6NO6]-1 Hg[H2C10H12N2O8] Hg[H3C14H18N3O10]
Common/IUPAC Name Mercury(II) cyanide Mercury(II) tricyanide ion(-1) Mercury(II) tetracyanide ion(-2) Mercury(II) diammonia ion(+2) Mercury(II) triammonia ion(+2) Mercury(II) tetraammonia ion(+2) Mercury(II) monohydroxide ethylenediamine ion(+1) Mercury(II) hydroxide Mercury(II) trihydroxide ion(-1) Mercury(II) thiocyanate Mercury(II) tri(thiocyanate) ion(-1) Mercury(II) tetra(thiocyanate) ion(-2) Mercury(II) EDTA ion(-2) Mercury(II) DTPA ion(-3) Mercury(II) monoacetate ion(+1) Mercury(II) acetate Mercury(II) triacetate ion(-1) Mercury(II) monoglycolate ion(+1) Mercury(II) glycolate Mercury(II) monoglycine ion(+1) Mercury(II) diglycine Mercury(II) mono(2-aminoethanol) ion(+2) Mercury(II) di(2-aminoethanol) ion(+2) Mercury(II) monoethylenediamine ion(+2) Mercury(II) di(ethylenediamine) ion(+2) Mercury(II) mono(N,N-diethanolamine) ion(+2) Mercury(II) di(N,N-diethanolamine) ion(+2) Mercury(II) tartrate Mercury(II) monotriethanolamine ion(+2) Mercury(II) di(triethanolamine) ion(+2) Mercury(II) citrate ion(-1) Mercury(II) NTA ion(-1) Mercury(II) dihydrogen EDTA Mercury(II) trihydrogen DTPA
Aspen HYSYSOLI Interface Name HGCN2 HGCN3ION HGCN4ION HGNH32ION HGNH33ION HGNH34ION HGOHEDAION HGOH2 HGOH3ION HGSCN2 HGSCN3ION HGSCN4ION HGEDTAION HGDTPAION HGACETION HGACET2 HGACET3ION HGGLYCOLION HGGLYCOL2 HGGLYCINION HGGLYCIN2 HGMEXHION HGMEXH2ION HGEDAION HGEDA2ION HGDEXHION HGDEXH2ION HGTARTRT HGTEXHION HGTEXH2ION HGCTRTION HGNTAION HGH2EDTA HGH3DTPA
A-80
Formula Hg[HC10H12N2O8]-1 Hg[HC14H18N3O10]-2 Hg[HC6H5O7] Hg[HC6H6NO6] Hg+2 Hg2(OH)2 Hg2+2 Hg2Cl2 Hg2CO3 Hg2OH+1 HgBr+1 HgBr2 HgBr-2 HgBr3-1 HgC2O4 HgCl+1 HgCl2 HgCl3-1 HgCl4-2 HgCN+1 HgF+1 HgF2 HgH[C2H8N2]+3 HgH2[C2H8N2]2+4 HgH2[C2H8N2]3+4 HgI+1 HgI2 HgI3-1 HgI4-2 HgMoO4 HgNH3+2 HgO HgOH+1 HgS HgSCN+1 HgSe
Common/IUPAC Name Mercury(II) hydrogen EDTA ion(-1) Mercury(II) hydrogen DTPA ion(-2) Mercury(II) hydrogen citrate Mercury(II) hydrogen NTA Mercury(II) ion(+2) Dimercury(I) dihydroxide Dimercury(I) ion (+2) Mercurous(I) chloride Mercury(I) carbonate Dimercury(I) hydroxide ion(+1) Mercury(II) monobromide ion(+1) Mercury(II) bromide Mercury(II) tetrabromide ion(-2) Mercury(II) tribromide ion(-1) Mercury(II) oxalate Mercury(II) monochloride ion(+1) Mercury(II) chloride Mercury(II) trichloride ion(-1) Mercury(II) tetrachloride ion(-2) Mercury(II) monocyanide ion(+1) Mercury(II) monofluoride ion(+1) Mercury(II) fluoride Mercury(II) hydrogen di(ethylenediamine) ion(+3) Mercury(II) dihydrogen di(ethylenediamine) ion(+4) Mercury(II) dihydrogen tri(ethylenediamine) ion(+4) Mercury(II) monoiodide ion(+1) Mercury(II) iodide Mercury(II) triiodide ion(-1) Mercury(II) tetraiodide ion(-2) Mercury(II) molybdate(VI) Mercury(II) monoammonia ion(+2) Mercury(II) oxide Mercury(II) monohydroxide ion(+1) Mercury(II) sulfide Mercury(II) monothiocyanate ion(+1) Mercury(II) selenide
Aspen HYSYSOLI Interface Name HGHEDTAION HGHDTPAION HGHCTRT HGHNTA HGION HG2OH2 HG2ION HG2CL2 HG2CO3 HG2OHION HGBRION HGBR2 HGBR4ION HGBR3ION HGC2O4 HGCLION HGCL2 HGCL3ION HGCL4ION HGCNION HGFION HGF2 HGHEDA2ION HGH2EDA2ION HGH2EDA3ION HGIION HGI2 HGI3ION HGI4ION HGMOO4 HGNH3ION HGO HGOHION HGS HGSCNION HGSE
A-81
A-82
Formula HgSeO3 HgSeO4 HgWO4 HI HI3 HIO HIO3 HIO4 HMnO4 HNbO3 HNO2 HNO3 Ho Ho(NO3)3 Ho(OH)[C6H6NO6]-1 Ho(OH)2+1 Ho(OH)3 Ho(OH)4-1 Ho(SO4)2-1 Ho[C10H12N2O8]-1 Ho[C14H18N3O10]-2 Ho[C2H3O2]+2 Ho[C2H3O2]2+1 Ho[C2H3O2]3 Ho[C6H5O7] Ho[C6H6NO6] Ho[C6H6NO6]2-3 Ho[H2C14H18N3O10] Ho[HC10H12N2O8] Ho[HC14H18N3O10]-1 Ho+3 Ho2(CO3)3 Ho2(SO4)3 Ho2(SO4)3.8H2O Ho2[C4H4O6]3 HO2-1 HO2C(CH2)2CH(NH2)C O2H
Common/IUPAC Name Mercury(II) selenite(IV) Mercury(II) selenate(VI) Mercury(II) tungstate(VI) Hydrogen iodide Hydrogen triiodide Hypoiodous(I) acid Iodic(V) acid Periodic(VII) acid Permanganic(VII) acid Niobic(V) acid Nitrous(III) acid Nitric(V) acid Holmium Holmium(III) nitrate Holmium(III) hydroxide NTA ion(-1) Holmium(III) dihydroxide ion(+1) Holmium(III) hydroxide Holmium(III) tetrahydroxide ion(-1) Holmium(III) disulfate ion(-1) Holmium(III) EDTA ion(-1) Holmium(III) DTPA ion(-2) Holmium(III) monoacetate ion(+2) Holmium(III) diacetate ion(+1) Holmium(III) acetate Holmium(III) citrate Holmium(III) NTA Holmium(III) di-NTA ion(-3) Holmium(III) dihydrogen DTPA Holmium(III) hydrogen EDTA Holmium(III) hydrogen DTPA ion(-1) Holmium ion(+3) Holmium(III) carbonate Holmium(III) sulfate Holmium(III) sulfate octahydrate Holmium(III) tartrate Hydrogen peroxide ion(-1) L-Glutamic acid
Aspen HYSYSOLI Interface Name HGSEO3 HGSEO4 HGWO4 HI HIOD3 HIO HIO3 HIODO4 HMNO4 HNBO3 HNO2 HNO3 HOEL HONO33 HOOHNTAION HOOH2ION HOOH3 HOOH4ION HOSO42ION HOEDTAION HODTPAION HOACETION HOACET2ION HOACET3 HOCTRT HONTA HONTA2ION HOH2DTPA HOHEDTA HOHDTPAION HOION HO2CO33 HO2SO43 HO2SO43.8H2O HO2TRTRT3 HO2ION LGLUTAMAC
A-82
Formula HO2C(CH2)2CH(NH2)C O2H HO2C(CH2)2CH(NH2)C O2H HoBr3 HoCl+2 HoCl2+1 HoCl3 HoCl3.6H2O HoCl4-1 HoCO3+1 HoF+2 HoF2+1 HoF3 HoF4-1 HoH2PO4+2 HoHCO3+2 HoNO3+2 HoOH+2 HoPO4 HoSO4+1 HP2O7-3 HPbO2-1 HPO3-2 HPO4-2 HReO4 HS-1 HSCN HSe-1 HSeCN HSeO3-1 HSeO4-1 HSO3-1 HSO4-1 HSO5-1 HTaO3 HTcO4 HTe-1
Common/IUPAC Name L-Glutamic acid L-Glutamic acid Holmium(III) bromide Holmium(III) monochloride ion(+2) Holmium(III) dichloride ion(+1) Holmium(III) chloride Holmium(III) chloride hexahydrate Holmium(III) tetrachloride ion(-1) Holmium(III) carbonate ion(+1) Holmium(III) monofluoride ion(+2) Holmium(III) difluoride ion(+1) Holmium fluoride Holmium(III) tetrafluoride ion(-1) Holmium(III) dihydrogen orthophosphate(V) ion(+2) Holmium(III) bicarbonate ion(+2) Holmium(III) mononitrate ion(+2) Holmium(III) monohydroxide ion(+2) Holmium(III) orthophosphate Holmium(III) monosulfate ion(+1) Hydrogen pyrophosphate(V) ion(-3) Hydrogen dioxylead ion(-1) Hydrogen metaphosphate(III) ion(-2) Hydrogen orthophosphate(V) ion (-2) Tetraoxorhenic(VII) acid Hydrogen sulfide ion (-1) Thiocyanic acid Hydrogen selinide ion (-1) Selenocyanic acid Hydrogen selenite(IV) ion (-1) Hydrogen selenate(VI) ion(-1) Bisulfite(IV) ion (-1) Bisulfate(VI) ion (-1) Hydrogen persulfate(VIII) ion (-1) Tantalic(V) acid Pertechnetic(VII) acid Hydrogen telluride ion(-1)
Aspen HYSYSOLI Interface Name DLGLUTAMAC GLUTAMACA HOBR3 HOCLION HOCL2ION HOCL3 HOCL3.6H2O HOCL4ION HOCO3ION HOFION HOF2ION HOF3 HOF4ION HOH2PO4ION HOHCO3ION HONO3ION HOOHION HOPO4 HOSO4ION HP2O7ION HPBO2ION HPO3ION HPO4ION HREO4 HSION HSCN HSEION HSECN HSEO3ION HSEO4ION HSO3ION HSO4ION HSO5ION HTAO3 HTCVIIO4 HTEION
A-83
A-84
Formula HTeO3-1 HVO4-2 HWO4-1 HZrF6-1 I-1 I2 I3-1 In In(OH)3 In+3 IO-1 IO3-1 IO4-1 Ir K K[B(C6H5)4] K[C10H12N2O8]-3 K[C2H3O2] K[C2H3O3] K[C2H3O3]2-1 K[C2H5COO] K[C4H4O4]-1 K[C4H4O6]-1 K[C6H5COO] K[C6H5O7]-2 K[Fe(CN)6]-2 K[Fe(CN)6]-3 K[H3C10H12N2O8] K[HC4H4O6] K[HCOO] K+1 K2[C4H4O4] K2[C4H4O4] K2[C4H4O4].3H2O K2Al2Si5O14.5H2O K2C2O4 K2C2O4.H2O K2CO3
Common/IUPAC Name Hydrogen tellurite(IV) ion(-1) Hydrogen pervanadate(V) ion(-2) Hydrogen tungstate(VI) ion(-1) Hydrogen hexafluorozirconic acid ion(-1) Iodide ion(-1) Iodine Triiodide ion(-1) Indium Indium(III) hydroxide Indium ion(+3) Hypoiodate(I) ion(-1) Iodate(VI) ion(-1) Periodate(VII) ion(-1) Iridium Potassium Potassium tetraphenylborate Potassium EDTA ion(-3) Potassium acetate Potassium glycolate Potassium diglycolate ion(-1) Potassium propionate Potasium succinate ion Potassium monotartrate ion(-1) Potassium benzoate Potassium citrate ion(-2) Monopotassium ferricyanide(III) ion(-2) Monopotassium ferrocyanide(II) ion(-3) Potassium trihydrogen EDTA Potassium hydrogen tartrate Potassium formate Potassium ion(+1) Potasium succinate Potasium succinate Potasium succinate trihydrate Dipotassium dialuminum pentasilicon tetradecaoxide pentahydrate Potassium oxalate Potassium oxalate monohydrate Potassium carbonate
Aspen HYSYSOLI Interface Name HTEIVO3ION HVO4ION HWO4ION HZRF6ION IODION IOD2EL IOD3ION INEL INOH3 INION IODOION IODO3ION IODO4ION IREL KEL KBPH4 K1EDTAION KACET KGLYCOLAT KGLYCOL2ION KPROP K1SUCCNATEION KTARTRTION KBNZAT KCTRTION K1FEIIICN6ION K1FEIICN6ION KH3EDTA KHTARTRT KCOOH KION K2SUCCNATE K2SUC K2SUC.3H2O KPHILL K2C2O4 K2C2O4.1H2O K2CO3 A-84
Formula K2CO3.1.5H2O K2Cr2O7 K2CrO4 K2HPO4 K2HPO4.3H2O K2HPO4.6H2O K2MoO4 K2S K2S2O8 K2Se K2SeO3 K2SeO3.4H2O K2SeO4 K2SO3 K2SO4 K2SO4.1H2O K2SO4.KNaSO4 K2TeO4 K2WO4 K3[C6H5O7] K3[C6H5O7].H2O K3[Fe(CN)6] K3PO4 K3PO4.3H2O K3PO4.7H2O K4[Fe(CN)6] K4[Fe(CN)6].3H2O KAl(SO4)2 KAl(SO4)2.12H2O KBO2 KBr KCl KClO KClO3 KCN
Common/IUPAC Name Potassium carbonate 1.5 hydrate Potassium dichromate(VI) Potassium chromate(VI) Potassium hydrogen phosphate(V) Potassium hydrogen orthophosphate(V) trihydrate Potassium hydrogen orthophosphate(V) hexahydrate Patassium molybdate(VI) Potassium sulfide Potassium persulfate(VII) Potassium selenide Potassium selenite(IV) Potassium selenite(IV) tetrahydrate Potassium selenate(VI) Potassium sulfite(IV) Potassium sulfate(VI) Potassium sulfate(VI) monohydrate Glaserite Potassium tellurate Potassium tungstate(VI) Potassium citrate Potassium citrate monohydrate Potassium ferricyanide(III) Potassium orthophosphate(V) Potassium orthophosphate(V) trihydrate Potassium orthophosphate(V) heptahydrate Potassium ferrocyanide(II) Potassium ferrocyanide(II) trihydrate Potassium aluminum sulfate Potassium aluminum sulfate dodecahydrate Potassium metaborate Potassium bromide Potassium chloride Potassium hypochlorite Potassium chlorate(V) Potassium cyanide
Aspen HYSYSOLI Interface Name K2CO3.1.5H2O K2CR2O7 K2CRO4 K2HPO4 K2HPO4.3H2O K2HPO4.6H2O K2MOO4 K2S K2S2O8 K2SE K2SEO3 K2SEO3.4H2O K2SEO4 K2SO3 K2SO4 K2SO4.1H2O K3NASO42 K2TEO4 K2WO4 K3CTRT K3CTRT.1H2O K3FEIIICN6 K3PO4 K3PO4.3H2O K3PO4.7H2O K4FECN6 K4FECN6.3H2O K1ALSO4 K1ALSO4.12H2O KBO2 KBR KCL KCLO KCLO3 KCN
A-85
A-86
Formula KF KF.2H2O KF.4H2O KH2AsO4 KH2PO4 KHCO3 KHS KHSO3 KHSO4 KI KIO3 KMgCl3 KMgCl3.2H2O KMnO4 KNbO3 KNH2CO2 KNO2 KNO3 KOH KOH.1H2O KOH.2H2O Kr KSCN KSO4-1 KTaO3 KTcO4 La La(NO3)3 La(NO3)3.6H2O La(OH)[C6H6NO6]-1 La(OH)2+1 La(OH)3 La(OH)4-1 La(SO4)2-1 La(SO4)3 La[C10H12N2O8]-1 La[C10H13N2O8] La[C14H18N3O10]-2
Common/IUPAC Name Potassium fluoride Potassium fluoride dihydrate Potassium fluoride tetrahydrate Potassium dihydrogen arsenate(V) Potassium dihydrogen orthophosphate(V) Potassium bicarbonate Potassium bisulfide Potassium bisulfite(IV) Potassium bisulfate(VI) Potassium iodide Potassium iodate Potassium magnesium chloride Potassium magnesium chloride dihydrate Potassium permanganate(VII) Potassium niobate(V) Potassium carbamate Potassium nitrite(III) Potassium nitrate(VI) Potassium hydroxide Potassium hydroxide monohydrate Potassium hydroxide dihydrate Krypton Potassium thiocyanate Potassium sulfate(VI) ion(-1) Potassium tantalate(V) Potassium pertechnetate(VII) Lanthanum Lanthanum(III) nitrate Lanthanum(III) nitrate hexahydrate Lanthanum(III) hydroxide NTA ion(-1) Lanthanum(III) dihydroxide ion(+1) Lanthanum(III) hydroxide Lanthanum(III) tetrahydroxide ion(-1) Lanthanum(III) disulfate ion(-1) Lanthanum(III) sulfate Lanthanum(III) EDTA ion(-1) Lanthanum(III) hydrogen EDTA Lanthanum(III) DTPA ion(-2)
Aspen HYSYSOLI Interface Name KF KF.2H2O KF.4H2O KH2ASO4 KH2PO4 KHCO3 KHS KHSO3 KHSO4 KI KIO3 KMGCL3 KMGCL3.2H2O KMNO4 KNBO3 KNH2CO2 KNO2 KNO3 KOH KOH.1H2O KOH.2H2O KR KSCN KSO4ION KTAO3 KTCVIIO4 LAEL LANO33 LANO33.6H2O LAOHNTAION LAOH2ION LAOH3 LAOH4ION LASO42ION LA2SO43 LAEDTAION LAHEDTA LADTPAION
A-86
Formula La[C2H3O2]+2 La[C2H3O2]2+1 La[C2H3O2]3 La[C4H4O6]+1 La[C4H4O6]2-1 La[C6H6NO6] La[C6H6NO6]-3 La[H2C14H18N3O10] La[HC14H18N3O10]-1 La[HC4H4O5]+2 La[HCOO]+2 La[HCOO]2+1 La[HCOO]3 La+3 La2(CO3)3 La2(MoO4)3 La2(SO4)3.9H2O La2(WO4)3 La2[C4H4O6]3 La2S3 LaCl+2 LaCl2+1 LaCl3 LaCl3.7H2O LaCl4-1 LaCO3+1 LaF+2 LaF2+1 LaF3 LaF3.0.5H2O LaF4-1 LaH2PO4+2 LaHCO3+2 LaNO3+2 LaOH+2 LaPO4
Common/IUPAC Name Lanthanum(III) monoacetate ion(+2) Lanthanum(III) diacetate ion(+1) Lanthanum(III) acetate Lanthanum(III) monotartrate ion(+1) Lanthanum(III) ditartrate ion(-1) Lanthanum(III) NTA Lanthanum(III) di-NTA ion(-3) Lanthanum(III) dihydrogen DTPA Lanthanum(III) hydrogen DTPA ion(-1) Lanthanum(III) hydrogen tartrate ion(+2) Lanthanum(III) monoformate ion(+2) Lanthanum(III) diformate ion(+1) Lantanum(III) formate Lanthanide ion(+3) Lanthanum(III) carbonate Lanthanum(III) molybdate(VI) Lanthanum(III) sulfate nonahydrate Lantanum(III) tungstate(VI) Lanthanum(III) tartrate Lanthanum(III) sulfide Lanthanum(III) monochloride ion(+2) Lanthanum(III) dichloride ion(+1) Lanthanum(III) chloride Lanthanum(III) chloride heptahydrate Lanthanum(III) tetrachloride ion(-1) Lanthanum(III) carbonate ion(+1) Lanthanum(III) monofluoride ion(+2) Lanthanum(III) difluoride ion(+1) Lanthanum(III) fluoride Lanthanum(III) fluoride hemihydrate Lanthanum(III) tetrafluoride ion(-1) Lanthanum(III) dihydrogen orthophosphate ion(+2) Lanthanum(III) bicarbonate ion(+2) Lanthanum(III) mononitrate ion(+2) Lanthanum(III) monohydroxide ion(+2) Lanthanum(III) orthophosphate(V)
Aspen HYSYSOLI Interface Name LAACETION LAACET2ION LAACET3 LATARTRTION LATARTRT2ION LANTA LANTA2ION LAH2DTPA LAHDTPAION LAHTARTRTION LACOOHION LACOOH2ION LACOOH3 LAION LA2CO33 LA2MOO43 LA2SO43.9H2O LA2WO43 LA2TARTRT3 LA2S3 LACLION LACL2ION LACL3 LACL3.7H2O LACL4ION LACO3ION LAFION LAF2ION LAF3 LAF3.0.5H2O LAF4ION LAH2PO4ION LAHCO3ION LANO3ION LAOHION LAPO4
A-87
A-88
Formula LaPO4.2H2O LaSO4+1 Li Li[B(C6H5)4] Li[C10H12N2O8]-3 Li[C14H18N3O10]-4 Li[C2H3O2] Li[C2H3O2].2H2O Li[C2H3O3] Li[C2H3O3]2-1 Li[C6H5O7]-2 Li[C6H6NO6]-2 Li[H2C6H5O7] Li[H2C6H6NO6] Li[H3C10H12N2O8] Li[H4C14H18N3O10] Li[HCOO] Li[HCOO].1H2O Li+1 Li2C2O4 Li2CO3 Li2CrO4 Li2CrO4.2H2O Li2MoO4 Li2MoO4.0.75H2O Li2S Li2SO3 Li2SO4 Li2SO4.1H2O Li2WO4 Li3VO4 Li3VO4.1H2O Li3VO4.9H2O LiBO2 LiBO2.2H2O LiBO2.8H2O LiCl LiCl.1H2O
Common/IUPAC Name Lanthanum(III) orthophosphate dihydrate Lanthanum(III) monosulfate ion(+1) Lithium Lithium tetraphenylborate Lithium EDTA ion(-3) Lithium DTPA ion(-4) Lithium acetate Lithium acetate dihydrate Lithium glycolate Lithium diglycolate ion(-1) Lithium citrate ion(-2) Lithium NTA ion(-2) Lithium dihydrogen citrate Lithium dihydrogen NTA Lithium trihydrogen EDTA Lithium tetrahydrogen DTPA Lithium formate Lithium formate monohydrate Lithium ion(+1) Lithium oxalate Lithium carbonate Lithium chromate(IV) Lithium chromate(IV) dihydrate Lithium molybdate(VI) Lithium molybdate(VI)-0.75-water Lithium sulfide Lithium sulfite(IV) Lithium sulfate(VI) Lithium sulfate(VI) monohydrate Lithium tungstate(VI) Lithium orthovanadate(V) Lithium orthovanadate(V) monohydrate Lithium orthovanadate(V) nonahydrate Lithium metaborate Lithium metaborate dihydrate Lithium metaborate octahydrate Lithium chloride Lithium chloride monohydrate
Aspen HYSYSOLI Interface Name LAPO4.2H2O LASO4ION LIEL LIBPH4 LIEDTAION LIDTPAION LIACET LIACET.2H2O LIGLYCOL LIGLYCOL2ION LICTRTION LINTAION LIH2CTRT LIH2NTA LIH3EDTA LIH4DTPA LICOOH LICOOH.1H2O LIION LI2C2O4 LI2CO3 LI2CRO4 LI2CRO4.2H2O LIMO LIMO.0.75H2O LI2S LI2SO3 LI2SO4 LI2SO4.1H2O LI2WO4 LI3VO4 LI3VO4.1H2O LI3VO4.9H2O LIBO2 LIBO2.2H2O LIBO2.8H2O LICL LICL.1H2O A-88
Formula LiCl.2H2O LiClO LiF LiH2BO3 LiHCO3 LiHS LiHSO3 LiNbO3 LiNH2CO2 LiOH LiOH.1H2O LiSO4-1 LiTaO3 LiVO3 Lu Lu(NO3)3 Lu(OH)[C6H6NO6]-1 Lu(OH)2+1 Lu(OH)3 Lu(OH)4-1 Lu(SO4)2-1 Lu[C10H12N2O8]-1 Lu[C14H18N3O10]-2 Lu[C2H3O2]+2 Lu[C2H3O2]2+1 Lu[C2H3O2]3 Lu[C4H4O6]+1 Lu[C6H5O7] Lu[C6H6NO6] Lu[C6H6NO6]2-3 Lu[H2C14H18N3O10] Lu[HC10H12N2O8] Lu[HC14H18N3O10]-1 Lu+3 Lu2(CO3)3 Lu2(SO4)3 Lu2(SO4)3.8H2O Lu2[C4H4O6]3
Common/IUPAC Name Lithium chloride dihydrate Lithium hypochlorite Lithium fluoride Lithium dihydrogen orthoborate Lithium bicarbonate Lithium bisulfide Lithium bisulfite(IV) Lithium niobate(V) Lithium carbamate Lithium hydroxide Lithium hydroxide monohydrate Lithium sulfate(VI) ion(-1) Lithium tantalate(V) Lithium metavanadate(V) Lutetium Lutetium(III) nitrate Lutetium(III) hydroxide NTA ion(-1) Lutetium(III) dihydroxide ion(+1) Lutetium(III) hydroxide Lutetium(III) tetrahydroxide ion(-1) Lutetium(III) disulfate ion(-1) Lutetium(III) EDTA ion(-1) Lutetium(III) DTPA ion(-2) Lutetium(III) monoacetate ion(+2) Lutetium(III) diacetate ion(+1) Lutetium(III) acetate Lutetium(III) monotartrate ion(+1) Lutetium(III) citrate Lutetium(III) NTA Lutetium(III) di-NTA ion(-3) Lutetium(III) dihydrogen DTPA Lutetium(III) hydrogen EDTA Lutetium(III) hydrogen DTPA ion(-1) Lutetium ion(+3) Lutetium(III) carbonate Lutetium(III) sulfate Lutetium(III) sulfate octahydrate Lutetium(III) tartrate
Aspen HYSYSOLI Interface Name LICL.2H2O LICLO LIF LIH2BO3 LIHCO3 LIHS LIHSO3 LINBO3 LINH2CO2 LIOH LIOH.1H2O LISO4ION LITAO3 LIVO3 LUEL LUNO33 LUOHNTAION LUOH2ION LUOH3 LUOH4ION LUSO42ION LUEDTAION LUDTPAION LUACETION LUACET2ION LUACET3 LUTRTRTION LUCTRT LUNTA LUNTA2ION LUH2DTPA LUHEDTA LUHDTPAION LUION LU2CO33 LU2SO43 LU2SO43.8H2O LU2TRTRT3
A-89
A-90
Formula LuCl+2 LuCl2+1 LuCl3 LuCl4-1 LuCO3+1 LuF+2 LuF2+1 LuF3 LuF4-1 LuH2PO4+2 LuHCO3+2 LuNO3+2 LuOH+2 LuSO4+1 Mg Mg(C2O4)2-2 Mg(HCO3)2 Mg(HCO3)2 Mg(HCO3)Cl Mg(HS)2 Mg(HSO3)2 Mg(HSO4)2 Mg(NH2CO2)2 Mg(NO2)2 Mg(NO3)2 Mg(NO3)2.2H2O Mg(NO3)2.6H2O Mg(NO3)2.6H2O Mg(OH)2 Mg(TcO4)2 Mg[C10H12N2O8]-2 Mg[C10H14N2O8] Mg[C14H18N3O10]-3 Mg[C2H3O2]+1 Mg[C2H3O2]2 Mg[C2H3O2]2.4H2O Mg[C2H3O3]+1 Mg[C2H3O3]2
Common/IUPAC Name Lutetium(III) monochloride (+2) Lutetium(III) dichloride ion(+1) Lutetium(III) chloride Lutetium(III) tetrachloride ion(-1) Lutetium(III) carbonate ion(+1) Lutetium(III) monofluoride ion(+2) Lutetium(III) difluoride ion(+1) Lutetium(III) fluoride Lutetium(III) tetrafluoride ion(-1) Lutetium(III) dihydrogen orthophosphate ion(+2) Lutetium(III) bicarbonate ion(+2) Lutetium(III) mononitrate ion(+2) Lutetium(III) monohydroxide ion(+2) Lutetium(III) monosulfate ion(+1) Magnesium Magnesium dioxalate ion(-2) Magnesium bicarbonate Magnesium bicarbonate bicarbonate Magnesium bicarbonate chloride Magnesium bisulfide Magnesium bisulfite(IV) Magnesium bisulfate(VI) Magnesium carbamate Magnesium nitrite(III) Magnesium nitrate(V) Magnesium nitrate(V) dihydrate Magnesium nitrate hexahydrate Manganese(II) nitrate hexahydrate Magnesium hydroxide Magnesium pertechnetate Magnesium EDTA ion(-2) Magnesium dihydrogen EDTA Magnesium DTPA ion(-3) Magnesium monoacetate ion(+1) Magnesium acetate Magnesium acetate tetrahydrate Magnesium monoglycolate ion(+1) Magnesium glycolate
Aspen HYSYSOLI Interface Name LUCLION LUCL2ION LUCL3 LUCL4ION LUCO3ION LUFION LUF2ION LUF3 LUF4ION LUH2PO4ION LUHCO3ION LUNO3ION LUOHION LUSO4ION MGEL MGC2O42ION MGHCO32 MGHCO3HCO3 MGHCO3CL MGHS2 MGHSO32 MGHSO42 MGNH2CO22 MGNO22 MGNO32 MGNO32.2H2O MGNO32.6H2O MNNO32.6H2O MGOH2 MGTCVIIO42 MGEDTAION MGH2EDTA MGDTPAION MGACETION MGACET2 MGACET2.4H2O MGGLYCOLION MGGLYC2 A-90
Formula Mg[C2H4NO2]+1 Mg[C2H4NO2]2 Mg[C2H5COO]+1 Mg[C2H5COO]2 Mg[C3H6NO2]+1 Mg[C3H6NO2]2 Mg[C4H4O6] Mg[C6H5COO]+1 Mg[C6H5COO]2 Mg[C6H5COO]2.4H2O Mg[C6H5O7]-1 Mg[C6H6NO6]-1 Mg[COOH]2 Mg[Fe(CN)6]-2 Mg[H2C6H5O7]+1 Mg[H3C14H18N3O10] Mg[HC10H12N2O8]-1 Mg[HC14H18N3O10]-2 Mg[HC4H4O6]+1 Mg[HC6H5O7] Mg[HC6H6NO6] Mg[HCOO]+1 Mg[HCOO]2.2H2O Mg+2 Mg1.25(SO4)(OH)0.5.0 .5H2O Mg1.5(SO4)(OH) Mg2[FeII(CN)6] Mg2Al2SiO5(OH)4 Mg3(PO4)2 Mg3(PO4)2.8H2O Mg4Al4Si2O10(OH)8 Mg7Si8O22(OH)2 MgBr2 MgBr2.6H2O
Common/IUPAC Name Magnesium monoglycine ion(+1) Magnesium diglycine Magnesium monopropanate ion(+1) Magnesium propanate Magnesium mono(L-alpha-alanine) ion(+1) Magnesium di(L-alpha-alanine) Magnesium tartrate Magnesium benzoate ion(+1) Magnesium benzoate Magnesium benzoate tetrahydrate Magnesium citrate ion(-1) Magnesium NTA ion(-1) Magnesium formate Magnesium monoferrocyanide(II) ion(-2) Magnesium dihydrogen citrate ion(+1) Magnesium trihydrogen DTPA Magnesium hydrogen EDTA ion(-1) Magnesium hydrogen DTPA ion(-2) Magnesium hydrogen tartrate ion(+1) Magnesium hydrogen citrate Magnesium hydrogen NTA Magnesium monoformate ion (+1) Magnesium formate dihydrate Magnesium ion(+2) Magnesium sulfate-0.25-(magnesium hydroxide)-hemihydrate Magnesium sulfate-0.5-(magnesium hydroxide) Magnesium ferrocyanide(II) Dimagnesium dialuminum silicon pentaoxide tetrahydroxide Magnesium orthophosphate(V) Magnesium orthophosphate(V) octahydrate Tetramagnesium tetraaluminum disilicon decaoxide octahydroxide Cumtonite Magnesium bromide Magnesium bromide hexahydrate
Aspen HYSYSOLI Interface Name MGGLYCINION MGGLYCIN2 MGPROPION MGPROP2 MGALANION MGALAN2 MGTRT MGBNZATION MGBNZT2 MGBNZT2.4H2O MGCTRTION MGNTAION MGCOOH2 MGFEIICN6ION MGH2CTRTION MGH3DTPA MGHEDTAION MGHDTPAION MGHTARTRTION MGHCTRT MGHNTA MGCOOHION MGCOOH2.2H2O MGION MGSO4OH.0.5H2O MGSO4OH MG2FEIICN6 AMESITE7A MG3PO42 MG3PO42.8H2O AMESITE14A CUMTONITE MGBR2 MGBR2.6H2O
A-91
A-92
Formula MgC2O4 MgC2O4.2H2O MgCl2 MgCl2.2H2O MgCl2.4H2O MgCl2.6H2O MgClHCO3 MgClHS MgClHSO4 MgClOH MgCO3 MgCO3.3H2O MgCr2O7 MgCr2O7.5H2O MgCr2O7.6H2O MgCrO4 MgF+1 MgF2 MgH2PO4+1 MgHCO3+1 MgHCO3HS MgHCO3HSO4 MgHCO3OH MgHPO4 MgHSiO3+1 MgI2 MgI2.6H2O MgI2.8H2O MgMoO4 MgMoO4.2H2O MgMoO4.5H2O MgMoO4.7H2O MgOH+1 MgP2O7-2 MgPO4-1 MgS MgSeO3
Common/IUPAC Name Magnesium oxalate Magnesium oxalate dihydrate Magnesium chloride Magnesium chloride dihydrate Magnesium chloride tetrahydrate Magnesium chloride hexahydrate Magnesium chloride bicarbonate Magnesium chloride bisulfide Magnesium chloride bisulfate(VI) Magnesium chloride hydroxide Magnesium carbonate Magnesium carbonate trihydrate Magnesium dichromate(VI) Magnesium dichromate(VI) pentahydrate Magnesium dichromate(VI) hexahydrate Magnesium chromate(VI) Magnesium monofluoride ion(+1) Magnesium fluoride Magnesium dihydrogen orthophosphate(V) ion(+1) Magnesium bicarbonate ion(+1) Magnesium bicarbonate bisulfide Magnesium bicarbonate bisulfate(VI) Magnesium bicarbonate hydroxide Magnesium hydrogen orthophosphate(V) Magnesium hydrogen metasilicate ion(+1) Magnesium iodide Magnesium iodide hexahydrate Magnesium iodide octahydrate Magnesium molybdate(VI) Magnesium molybdate(VI) dihydrate Magnesium molybdate(VI) pentahydrate Magnesium molybdate(VI) heptahydrate Magnesium hydroxide ion(+1) Magnesium pyrophosphate(V) ion(-2) Magnesium orthophosphate(V) ion(-1) Magnesium sulfide Magnesium selenite(IV)
Aspen HYSYSOLI Interface Name MGC2O4 MGC2O4.2H2O MGCL2 MGCL2.2H2O MGCL2.4H2O MGCL2.6H2O MGCLHCO3 MGCLHS MGCLHSO4 MGCLOH MGCO3 MGCO3.3H2O MGCR2O7 MGCR2O7.5H2O MGCR2O7.6H2O MGCRO4 MGFION MGF2 MGH2PO4ION MGHCO3ION MGHCO3HS MGHCO3HSO4 MGHCO3OH MGHPO4 MGHSIO3ION MGI2 MGI2.6H2O MGI2.8H2O MGMOO4 MGMOO4.2H2O MGMOO4.5H2O MGMOO4.7H2O MGOHION MGP2O7ION MGPO4ION MGS MGSEO3
A-92
Formula MgSeO3.6H2O MgSeO4 MgSeO4.4H2O MgSeO4.6H2O MgSeO4.H2O MgSiO2(OH)2 MgSO3 MgSO3.3H2O MgSO3.6H2O MgSO4 MgSO4.1H2O MgSO4.6H2O MgSO4.7H2O MgTeO3 MgTeO3.5H2O MgTeO3.6H2O MgWO4 Mn Mn(C2O4)2-2 Mn(C2O4)3-4 Mn(HCO3)2 Mn(HS)2 Mn(HSO3)2 Mn(HSO4)3 Mn(NH2CO2)2 Mn(NO3)2 Mn(NO3)2.1H2O Mn(NO3)2.4H2O Mn(OH)+1 Mn(OH)2 Mn(OH)3-1 Mn(OH)4-2 Mn(VO3)2 Mn[C10H12N2O8]-2 Mn[C10H14N2O8] Mn[C14H18N3O10]-3 Mn[C2H3O2]+1 Mn[C2H3O2]2
Common/IUPAC Name Magnesium selenite(IV) hexahydrate Magnesium selenate(VI) Magnesium selenate(VI) tetrahydrate Magnesium selenate(VI) hexahydrate Magnesium selenate(VI) monohydrate Magnesium dihydrogen orthosilicate Magnesium sulfite Magnesium sulfite trihydrate Magnesium sulfite hexahydrate Magnesium sulfate Magnesium sulfate monohydrate Magnesium sulfate hexahydrate Magnesium sulfate heptahydrate Magnesium tellurite(IV) Magnesium tellurite(IV) pentahydrate Magnesium tellurite(IV) hexahydrate Magnesium tungstate(VI) Manganese Manganese(II) dioxalate ion(-2) Manganese(II) trioxalate ion(-4) Manganese(II) bicarbonate Manganese(II) bisulfide Manganese(II) bisulfite Manganese(II) bisulfate Manganese(II) carbamate Manganese(II) nitrate Manganese(II) nitrate monohydrate Manganese(II) nitrate tetrahydrate Manganese(II) monohydroxide ion (+1) Manganese(II) hydroxide Manganese(II) trihydroxide ion(-1) Manganese(II) tetrahydroxide ion(-2) Manganese(II) metavanadate Manganese(II) EDTA ion(-2) Manganese(II) dihydrogen EDTA Manganese(II) DTPA ion(-3) Manganese(II) monoacetate ion(+1) Manganese(II) acetate
Aspen HYSYSOLI Interface Name MGSEO3.6H2O MGSEO4 MGSEO4.4H2O MGSEO4.6H2O MGSEO4.1H2O MGH2SIO4 MGSO3 MGSO3.3H2O MGSO3.6H2O MGSO4 MGSO4.1H2O MGSO4.6H2O MGSO4.7H2O MGTEO3 MGTEO3.5H2O MGTEO3.6H2O MGWO4 MNEL MNC2O42ION MNC2O43ION MNHCO32 MNHS2 MNHSO32 MNHSO42 MNNH2CO22 MNNO32 MNNO32.1H2O MNNO32.4H2O MNOHION MNOH2 MNOH3ION MNOH4ION MNVO32 MNEDTAION MNH2EDTA MNDTPAION MNACETION MNACET2
A-93
A-94
Formula Mn[C2H3O2]3-1 Mn[C2H3O3]+1 Mn[C2H3O3]2 Mn[C2H4NO2]+1 Mn[C2H4NO2]2 Mn[C2H8N2]+2 Mn[C2H8N2]2+2 Mn[C3H6NO2]+1 Mn[C3H6NO2]2 Mn[C4H4O6] Mn[C6H5O7]-1 Mn[C6H6NO6]-1 Mn[C6H6NO6]2-4 Mn[H3C14H18N3O10] Mn[HC10H12N2O8]-1 Mn[HC14H18N3O10]-2 Mn[HC6H5O7] Mn[HC6H6NO6] Mn[HCOO]+1 Mn[HCOO]2 Mn+2 Mn2[C14H18N3O10]-1 Mn3(PO4)2 Mn3(PO4)2.6H2O Mn3PO42.3H2O MnBr+1 MnBr2 MnBr2.2H2O MnBr2.4H2O MnC2O4 MnC2O4.2H2O MnCl+1 MnCl2 MnCl2.1H2O MnCl2.2H2O
Common/IUPAC Name Manganese(II) triacetate ion(-1) Manganese(II) monoglycolate ion(+1) Manganese(II) glycolate Manganese(II) monoglycine ion(+1) Manganese(II) diglycine Manganese(II) monoethylenediamine ion(+2) Manganese(II) di(ethylenediamine) ion(+2) Manganese(II) mono(L-alpha-alanine) ion(+1) Manganese(II) di(L-alpha-alanine) Manganese(II) tartrate Manganese(II) citrate ion(-1) Manganese(II) NTA ion(-1) Manganese(II) di-NTA ion(-4) Manganese(II) trihydrogen DTPA Manganese(II) hydrogen EDTA ion(-1) Manganese(II) hydrogen DTPA ion(-2) Manganese(II) hydrogen citrate Manganese(II) hydrogen NTA Manganese(II) monoformate ion(+1) Manganese(II) formate Manganese ion(+2) Dimanganese(II) DTPA ion(-1) Manganese(II) orthophosphate Manganese(II) orthophosphate hexahydrate Manganese(II) orthophosphate trihydrate Manganese(II) monobromide ion(+1) Manganese(II) bromide Manganese(II) bromide dihydrate Manganese(II) bromide tetrahydrate Manganese(II) oxalate Manganese(II) oxalate dihydrate Manganese(II) monochloride ion(+1) Manganese(II) chloride Manganese(II) chloride monohydrate Manganese(II) chloride dihydrate
Aspen HYSYSOLI Interface Name MNACET3ION MNGLYCOLION MNGLYCOL2 MNGLYCINION MNGLYCIN2 MNEDAION MNEDA2ION MNALANION MNALAN2 MNTARTRT MNCTRTION MNNTAION MNNTA2ION MNH3DTPA MNHEDTAION MNHDTPAION MNHCTRT MNHNTA MNCOOHION MNCOOH2 MNION MN2DTPAION MN3PO42 MN3PO42.6H2O MN3PO42.3H2O MNBRION MNBR2 MNBR2.2H2O MNBR2.4H2O MNC2O4 MNC2O4.2H2O MNCLION MNCL2 MNCL2.1H2O MNCL2.2H2O
A-94
Formula MnCl2.4H2O MnCO3 MnF2 MnF2.4H2O MnI2 MnI2.4H2O MnMoO4 MnNO3+1 MnO4-1 MnO4-2 MnOHCl MnOHHCO3 MnS MnSe MnSeO4 MnSeO4.H2O MnSO3 MnSO4 MnSO4.1H2O MnSO4.5H2O MnSO4.7H2O MnWO4 Mo MoO2 MoO3 MoO4-2 N2 N2H4 N2H5+1 N2O N2O4 Na Na[B(C6H5)4] Na[C10H12N2O8]-3 Na[C2H3O2] Na[C2H3O2].3H2O Na[C2H3O3] Na[C3H5O2]
Common/IUPAC Name Manganese(II) chloride tetrahydrate Manganese(II) carbonate Manganese(II) fluoride Manganese(II) fluoride tetrahydrate Manganese(II) iodide Manganese(II) iodide tetrahydrate Manganese(II) molybdate(VI) Manganese(II) nitrate ion(+1) Manganate ion(-1) Manganate(VI) ion(-2) Manganese(II) hydroxide bicarbonate Manganese(II) sulfide Manganese(II) selenide Manganese(II) selenate Manganese(II) selenate monohydrate Manganese(II) sulfite Manganese(II) sulfate Manganese(II) sulfate monohydrate Manganese(II) sulfate pentahydrate Manganese(II) sulfate heptahydrate Manganese(II) tungstate(VI) Molybdenum Molybdenum(IV) oxide Molybdenum(VI) oxide Molybdenate(VI) ion(-2) Nitrogen Hydrazine Hydrogen hydrazine ion(+1) Nitrous oxide Dinitrogen tetroxide Sodium Sodium tetraphenylborate Sodium EDTA ion(-3) Sodium acetate Sodium acetate trihydrate Sodium glycolate Sodium propanate
Aspen HYSYSOLI Interface Name MNCL2.4H2O MNCO3 MNF2 MNF2.4H2O MNI2 MNI2.4H2O MNMOO4 MNNO3ION MNVIIO4ION MNO4ION MNOHCL MNOHHCO3 MNS MNSE MNSEO4 MNSEO4.1H2O MNSO3 MNSO4 MNSO4.1H2O MNSO4.5H2O MNSO4.7H2O MNWO4 MOEL MOO2 MOO3 MOO4ION N2 N2H4 N2H5ION N2O N2O4 NAEL NABPH4 NAEDTAION NAACET NAACET.3H2O NAGLYCOLAT NAPROP
A-95
A-96
Formula Na[C3H5O3] Na[C4H4O4]-1 Na[C4H4O6]-1 Na[C6H5COO] Na[C6H5O7]-2 Na[C6H6NO6]-2 Na[H2C6H5O7] Na[H2C6H6NO6] Na[HC10H14N2O8] Na[HC4H4O6] Na+1 Na2[C4H4O4] Na2[C4H4O4] Na2[C4H4O4].6H2O Na2[H2C10H12N2O8] Na2[PtCl6] Na2[PtCl6].6H2O Na2Al2Si3O10.2H2O Na2Al2Si5O14.5H2O Na2B4O7 Na2B4O7.10H2O Na2B4O7.4H2O Na2B4O7.5H2O Na2C2O4 Na2CO3 Na2CO3.10H2O Na2CO3.1H2O Na2CO3.7H2O Na2Cr2O7 Na2Cr2O7.2H2O Na2CrO4 Na2CrO4.10H2O Na2CrO4.4H2O Na2CrO4.6H2O Na2F+1 Na2H4TeO6 Na2HAsO4
Common/IUPAC Name Sodium lactate Sodium succinate ion Sodium tartrate ion(-1) Sodium benzoate Sodium citrate ion(-2) Sodium NTA ion(-2) Sodium dihydrogen citrate Sodium dihydrogen NTA Sodium trihydrogen EDTA Sodium hydrogen tartrate Sodium ion(+1) Sodium succinate Sodium succinate Sodium succinate hexahydrate Disodium dihydrogen EDTA Sodium hexachloroplatinate(IV) Sodium hexachloroplatinate(IV) hexahydrate Disodium dialuminum trisilicon decaoxide dihydrate Sodium aluminum silicate pentahydrate Sodium tetraborate Sodium tetraborate decahydrate Sodium tetraborate tetrahydrate Sodium tetraborate pentahydrate Sodium oxalate Sodium carbonate Sodium carbonate decahydrate Sodium carbonate monohydrate Sodium carbonate heptahydrate Sodium bichromate Sodium dichromate dihydrate Sodium chromate(VI) Sodium chromate(VI) decahydrate Sodium chromate(VI) tetrahydrate Sodium chromate(VI) hexahydrate Disodium fluoride ion(+1) Disodium tetrahydrogen tellurate(VI) Sodium biarsenate
Aspen HYSYSOLI Interface Name NALACTAT NASUCCNATION NATARTRTION NABNZAT NACTRTION NANTAION NAH2CTRT NAH2NTA NAH3EDTA NAHTARTRT NAION NA2SUCCNAT NA2SUC NA2SUC.6H2O NA2H2EDTA NAPTCL6 NAPTCL6.6H2O NATROLITE NAPHILL NA2B4O7 NA2B4O7.10H2O NA2B4O7.4H2O NA2B4O7.5H2O NA2C2O4 NA2CO3 NA2CO3.10H2O NA2CO3.1H2O NA2CO3.7H2O NA2CR2O7 NA2CR2O7.2H2O NA2CRO4 NA2CRO4.10H2O NA2CRO4.4H2O NA2CRO4.6H2O NA2FION NA2H4TEO6 NA2HASO4
A-96
Formula Na2HPO4 Na2HPO4.12H2O Na2HPO4.2H2O Na2HPO4.7H2O Na2MoO4 Na2MoO4.10H2O Na2MoO4.2H2O Na2O.Al2O3 Na2O.Al2O3.2.5H2O Na2S Na2S.9H2O Na2S2O3 Na2S2O3.2H2O Na2S2O3.5H2O Na2S5 Na2Se Na2SeO3 Na2SeO3.5H2O Na2SeO4 Na2SeO4.10H2O Na2SO3 Na2SO3.7H2O Na2SO4 Na2SO4.(NH4)2SO4 Na2SO4.(NH4)2SO4.4H 2O Na2SO4.10H2O Na2SO4.NaHSO4 Na2Te Na2TeO3 Na2TeO3.5H2O Na2TeO4 Na2WO4 Na2WO4.2H2O Na2ZrF6 Na3AsO4
Common/IUPAC Name Sodium hydrogen orthophosphate Sodium hydrogen orthophosphate dodecahydrate Sodium hydrogen orthophosphate dihydrate Sodium hydrogen orthophosphate heptahydrate Sodium molybdate(VI) Sodium molybdate(VI) decahydrate Sodium molybdate(VI) dihydrate Sodium aluminum oxide Sodium aluminum oxide 2.5 hydrate Sodium sulfide Sodium sulfide nonahydrate Sodium thiosulfate Sodium thiosulfate dihydrate Sodium thiosulfate pentahydrate Disodium pentasulfide Sodium selenide Sodium selenite(IV) Sodium selenite(IV) pentahydrate Sodium selenate(VI) Sodium selenate(VI) decahydrate Sodium sulfite Sodium sulfite heptahydrate Sodium sulfate Sodium ammonium sulfate Sodium ammonium sulfate tetrahydrate Sodium sulfate decahydrate Sodium sulfate bisulfate Sodium telluride Sodium tellurite(IV) Sodium tellurite(IV) pentahydrate Sodium tellurate(VI) Sodium tungstate(VI) Sodium tungstate(VI) dihydrate Disodium hexafluorozirconate Sodium arsenate(V)
Aspen HYSYSOLI Interface Name NA2HPO4 NA2HPO4.12H2O NA2HPO4.2H2O NA2HPO4.7H2O NA2MOO4 NA2MOO4.10H2O NA2MOO4.2H2O NAALO22 NAALO22.2.5H2O NA2S NA2S.9H2O NA2S2O3 NA2S2O3.2H2O NA2S2O3.5H2O NA2S5 NA2SE NA2SEO3 NA2SEO3.5H2O NA2SEO4 NA2SEO4.10H2O NA2SO3 NA2SO3.7H2O NA2SO4 NANH4SO4 NANH4SO4.4H2O NA2SO4.10H2O NA3HSO42 NA2TE NA2TEO3 NA2TEO3.5H2O NA2TEO4 NA2WO4 NA2WO4.2H2O NA2ZRF6 NA3ASO4
A-97
A-98
Formula Na3PO4 Na3PO4.0.25NaOH Na3PO4.0.25NaOH.12H 2O Na3PO4.1H2O Na3PO4.6H2O Na3PO4.8H2O Na3VO4 Na4P2O7 Na4P2O7.10H2O Na5P3O10 Na5P3O10.6H2O Na7F(PO4)2 Na7F(PO4)2.19H2O NaAlCO3(OH)2 NaALO2 NaB(OH)4 NaB5O8 NaB5O8.5H2O NaBO2 NaBO2.0.5H2O NABO2.2H2O NaBO2.4H2O NaBr NaBr.2H2O NaCl NaClO NaClO2 NaClO2.3H2O NaClO3 NaClO4 NaClO4.1H2O NaCN NaCN.2H2O NaCNO NaCO3-1 NaCOOH
Common/IUPAC Name Sodium orthohosphate Sodium orthophosphate hydroxide Sodium orthophosphate hydroxide dodecahydrate Sodium orthophosphate monohydrate Sodium orthophosphate hexahydrate Sodium orthophosphate octahydrate Sodium orthovanadate(V) Sodium pyrophosphate(V) Sodium pyrophosphate decahydrate Pentasodium triphosphorous decaoxide Pentasodium triphosphorous decaoxide hexahydrate Heptasodium fluoride diphosphate Heptasodium fluoride diphosphate nonadecahydrate Sodium aluminum dihydroxide carbonate Sodium aluminate Sodium boron hydroxide Sodium pentaborate Sodium metaborate Sodium metaborate hemihydrate Sodium metaborate dihydrate Sodium metaborate tetrahydrate Sodium bromide Sodium bromide dihydrate Sodium chloride Sodium hypochlorite Sodium chlorite Sodium chlorite trihydrate Sodium chlorate(V) Sodium perchlorate(VII) Sodium perchlorate(VII) monohydrate Sodium cyanide Sodium cyanide dihydrate Sodium cyanate Sodium carbonate ion(-1) Sodium formate
Aspen HYSYSOLI Interface Name NA3PO4 NAPHOH NAPHOH.12H2O NA3PO4.1H2O NA3PO4.6H2O NA3PO4.8H2O NA3VO4 NA4P2O7 NA4P2O7.10H2O NA5P3O10 NA5P3O10.6H2O NAFPO4 NAFPO4.19H2O NAALCO3OH2 NAALO2 NABOH4 NAB5O8 NAB5O8.5H2O NABO2 NABO2.0.5H2O NABO2.2H2O NABO2.4H2O NABR NABR.2H2O NACL NACLO NACLO2 NACLO2.3H2O NACLO3 NACLO4 NACLO4.1H2O NACN NACN.2H2O NACNO NACO3ION NACOOH
A-98
Formula NaCOOH.2H2O NaCOOH.3H2O NaF NaF.Na2SO4 NaH[C4H4O4] NaH[C4H4O4] NaH[C4H4O4].3H2O NaH2BO3 NaH2PO4 NaH2PO4.1H2O NaH2PO4.2H2O NaHCO3 NaHF2 NaHS NaHSiO3 NaHSO3 NaHSO4 NaI NaI.2H2O NaIO3 NaIO3.1H2O NaIO3.5H2O NaMnO4 NaMnO4.1H2O NaMnO4.3H2O NaNbO3 NaNH2CO2 NaNO2 NaNO3 NaOH NaOH.1H2O NaS2O3-1 NaSCN NaSCN.1H2O NaSO4-1 NaTaO3 NaTcO4
Common/IUPAC Name Sodium formate dihydrate Sodium formate trihydrate Sodium fluoride Sodium fluoride sulfate Sodium hydrogen succinate Sodium hydrogen succinate Sodium hydrogen succinate trihydrate Sodium dihydrogen orthoborate Sodium dihydrogen orthoporthohosphate Sodium dihydrogen orthophosphate monohydrate Sodium dihydrogen orthophosphate dihydrate Sodium bicarbonate Sodium hydrogen difluoride Sodium bisulfide Sodium hydrogen metasilicate Sodium bisulfite Sodium bisulfate Sodium iodide Sodium iodide dihydrate Sodium iodate Sodium iodate monohydrate Sodium iodate pentahydrate Sodium permanganate(VII) Sodium permanganate(VII) monohydrate Sodium permanganate(VII) trihydrate Sodium niobium trioxide Sodium carbamate Sodium nitrite Sodium nitrate Sodium hydroxide Sodium hydroxide monohydrate Sodium thiosulfate(II) ion(-1) Sodium thiocyanate Sodium thiocyanate monohydrate Sodium sulfate ion(-1) Sodium tantalate(V) Sodium pertechnetate(VII)
Aspen HYSYSOLI Interface Name NACOOH.2H2O NACOOH.3H2O NAF NA3FSO4 NAHSUCCNAT NAHSUC NAHSUC.3H2O NAH2BO3 NAH2PO4 NAH2PO4.1H2O NAH2PO4.2H2O NAHCO3 NAHF2 NAHS NAHSIO3 NAHSO3 NAHSO4 NAI NAI.2H2O NAIO3 NAIO3.1H2O NAIO3.5H2O NAMNO4 NAMNO4.1H2O NAMNO4.3H2O NANBO3 NANH2CO2 NANO2 NANO3 NAOH NAOH.1H2O NAS2O3ION NASCN NASCN.1H2O NASO4ION NATAO3 NATCVIIO4
A-99
A-100
Formula NaVO3 NaZrF5 NaZrF5.1H2O Nb Nb2O5 NbBr5 NbCl5 NbF5 NbI5 NbO3-1 NbOCl3 Nd Nd(NO3)3 Nd(NO3)3.6H2O Nd(OH)[C6H6NO6]-1 Nd(OH)2+1 Nd(OH)3 Nd(OH)4-1 Nd(SO4)2-1 Nd[C10H12N2O8]-1 Nd[C14H18N3O10]-2 Nd[C2H3O2]+2 Nd[C2H3O2]2+1 Nd[C2H3O2]3 Nd[C4H4O6]+1 Nd[C6H5O7] Nd[C6H6NO6] Nd[C6H6NO6]2-3 Nd[H2C14H18N3O10] Nd[HC10H12N2O8] Nd[HC14H18N3O10]-1 Nd+3 Nd2(CO3)3 Nd2(SO4)3 Nd2(SO4)3.8H2O Nd2(WO4)3 Nd2[C4H4O6]3 NdBr3
Common/IUPAC Name Sodium metavanadate(V) Sodium pentafluorozirconate Sodium pentafluorozirconate monohydrate Niobium Niobium(V) oxide Niobium(V) bromide Niobium(V) chloride Niobium(V) fluoride Niobium(V) iodide Niobate(V) ion(-1) Niobium(V) oxychloride Neodymium Neodymium(III) nitrate Neodymium(III) nitrate hexahydrate Neodymium(III) hydroxide NTA ion(-1) Neodymium(III) dihydroxide ion(+1) Neodymium(III) hydroxide Neodymium(III) tetrahydroxide ion(-1) Neodymium(III) disulfate ion(-1) Neodymium(III) EDTA ion(-1) Neodymium(III) DTPA ion(-2) Neodymium(III) monoacetate ion(+2) Neodymium(III) diacetate ion(+1) Neodymium(III) acetate Neodymium(III) tartrate ion(+1) Neodymium(III) citrate Neodymium(III) NTA Neodymium(III) di-NTA ion(-3) Neodymium(III) dihydrogen DTPA Neodymium(III) hydrogen EDTA Neodymium(III) hydrogen DTPA ion(-1) Neodymium ion(+3) Neodymium(III) carbonate Neodymium(III) sulfate Neodymium(III) sulfate octahydrate Neodymium(III) tungstate(V) Neodymium(III) tartrate Neodymium(III) bromide
Aspen HYSYSOLI Interface Name NAVO3 NAZRF5 NAZRF5.1H2O NBEL NB2O5 NBBR5 NBCL5 NBF5 NBI5 NBO3ION NBOCL3 NDEL NDNO33 NDNO33.6H2O NDOHNTAION NDOH2ION NDOH3 NDOH4ION NDSO42ION NDEDTAION NDDTPAION NDACETION NDACET2ION NDACET3 NDTRTRTION NDCTRT NDNTA NDNTA2ION NDH2DTPA NDHEDTA NDHDTPAION NDION ND2CO33 ND2SO43 ND2SO43.8H2O ND2WO43 ND2TRTRT3 NDBR3 A-100
Formula NdCl+2 NdCl2+1 NdCl3 NdCl3.6H2O NdCl4-1 NdCO3+1 NdF+2 NdF2+1 NdF3 NdF4-1 NdH2PO4+2 NdHCO3+2 NdI3 NdNO3+2 NdOH+2 NdPO4 NdPO4.2H2O NdSO4+1 Ne NH2CO2-1 NH2OH NH2OH2+1 NH3 NH4[B(C6H5)4] NH4[C2H3O2] NH4[C3H5O3] NH4[HCOO] NH4+1 NH4Cl NH4ClO4 NH4CN NH4F NH4H2PO4 NH4HCO3 NH4HF2 NH4HS NH4HSO3
Common/IUPAC Name Neodymium(III) monochloride ion(+2) Neodymium(III) dichloride ion(+1) Neodymium(III) chloride Neodymium(III) chloride hexahydrate Neodymium(III) tetrachloride ion(-1) Neodymium(III) carbonate ion(+1) Neodymium(III) monofluoride ion(+2) Neodymium(III) difluoride ion(+1) Neodymium(III) fluoride Neodymium(III) tetrafluoride ion(-1) Neodymium(III) dihydrogen orthophosphate ion(+2) Neodymium(III) bicarbonate ion(+2) Neodymium(III) iodide Neodymium(III) mononitrate ion(+2) Neodymium(III) monohydroxide ion(+2) Neodymium(III) orthophosphate Neodymium(III) orthophosphate dihydrate Neodymium(III) monosulfate ion(+1) Neon Carbamate ion(-1) Hydroxylamine Hydrogen hydroxylamine ion(+1) Ammonia Ammonium tetraphenylborate Ammonium acetate Ammonium lactate Ammonium formate Ammonium ion(+1) Ammonium chloride Ammonium perchlorate Ammonium cyanide Ammonium fluoride Ammonium dihydrogen orthophosphate Ammonium bicarbonate Ammonium hydrogen difluoride Ammonium bisulfide Ammonium bisulfite
Aspen HYSYSOLI Interface Name NDCLION NDCL2ION NDCL3 NDCL3.6H2O NDCL4ION NDCO3ION NDFION NDF2ION NDF3 NDF4ION NDH2PO4ION NDHCO3ION NDI3 NDNO3ION NDOHION NDPO4 NDPO4.2H2O NDSO4ION NE NH2CO2ION HDROXAMN HHDRAMION NH3 NH4BPH4 NH4ACET NH4LACTAT NH4COOH NH4ION NH4CL NH4CLO4 NH4CN NH4F NH4H2PO4 NH4HCO3 NH4HF2 NH4HS NH4HSO3
A-101
A-102
Formula NH4NO3 NH4OH NH4SO4-1 NH4VO3 Ni Ni(C2O4)2-2 Ni(CN)2 Ni(CN)4-2 Ni(H2PO4)2 Ni(NH3)2+2 Ni(NH3)3+2 Ni(NH3)4+2 Ni(NH3)5+2 Ni(NH3)6+2 Ni(NO3)2 Ni(NO3)2.2H2O Ni(NO3)2.4H2O Ni(NO3)2.6H2O Ni(OH)[C10H12N2O8]3 Ni(OH)2 Ni(OH)3-1 Ni(SCN)2 Ni(SeCN)2 Ni[C10H12N2O8]-2 Ni[C10H14N2O8] Ni[C14H18N3O10]-3 Ni[C2H3O2]+1 Ni[C2H3O2]2 Ni[C2H3O2]3-1 Ni[C2H3O3]+1 Ni[C2H3O3]2 Ni[C2H4NO2]+1 Ni[C2H4NO2]2 Ni[C2H7NO]+2 Ni[C2H7NO]2+2 Ni[C2H7NO]3+2 Ni[C2H8N2]+2 Ni[C2H8N2]2+2
Common/IUPAC Name Ammonium nitrate Ammonium hydroxide Ammonium sulfate ion(-1) Ammonium vanadate(V) Nickel Nickel(II) dioxalate ion(-2) Nickel(II) cyanide Nickel(II) tetracyanide ion(-2) Nickel(II) dihydrogen orthophosphate Nickel(II) diammonia ion(+2) Nickel(II) triammonia ion(+2) Nickel(II) tetraammonia ion(+2) Nickel(II) pentaammonia ion(+2) Nickel(II) hexaammonia ion(+2) Nickel(II) nitrate Nickel(II) nitrate dihydrate Nickel(II) nitrate tetrahydrate Nickel(II) nitrate hexahydrate Nickel(II) hydroxide EDTA ion(-3) Nickel(II) hydroxide Nickel(II) trihydroxide ion(-1) Nickel(II) thiocyanate Nickel(II) selenocyanate Nickel(II) EDTA ion(-2) Nickel dihydrogen EDTA Nickel DTPA ion(-3) Nickel monoacetate ion(+1) Nickel acetate Nickel triacetate ion(-1) Nickel monoglycolate ion(+1) Nickel diglycolate Nickel monoglycine ion(+1) Nickel diglycine Nickel mono(2-aminoethanol) ion(+2) Nickel di(2-aminoethanol) ion(+2) Nickel tri(2-aminoethanol) ion(+2) Nickel monoethylenediamine ion(+2) Nickel di(ethylenediamine) ion(+2)
Aspen HYSYSOLI Interface Name NH4NO3 NH4OH NH4SO4ION NH4VO3 NIEL NIC2O42ION NICN2 NICN4ION NIH2PO42 NINH32ION NINH33ION NINH34ION NINH35ION NINH36ION NINO32 NINO32.2H2O NINO32.4H2O NINO32.6H2O NIOHEDTAION NIOH2 NIOH3ION NISCN2 NISECN2 NIEDTAION NIH2EDTA NIDTPAION NIACETION NIACET2 NIACET3ION NIGLYCOLION NIGLYCOL2 NIGLYCINION NIGLYCIN2 NIMEXHION NIMEXH2ION NIMEXH3ION NIEDAION NIEDA2ION A-102
Formula Ni[C2H8N2]3+2 Ni[C3H6NO2]+1 Ni[C3H6NO2]2 Ni[C6H15NO3]+2 Ni[C6H15NO3]2+2 Ni[C6H5O7]-1 Ni[C6H6NO6]-1 Ni[C6H6NO6]-4 Ni[H2C14H18N3O10]-1 Ni[H2C6H5O7]+1 Ni[H3C14H18N3O10] Ni[HC10H12N2O8]-1 Ni[HC14H18N3O10]-2 Ni[HC6H5O7] Ni[HC6H6NO6] Ni[HCOO]+1 Ni[HCOO]2 Ni+2 Ni2[C14H18N3O10]-1 Ni3(PO4)2 NiBr2 NiBr2.6H2O NiC2O4 NiC2O4.2H2O NiCl+1 NiCl2 NiCl2.2H2O NiCl2.4H2O NiCl2.6H2O NiCO3 NiF+1 NiF2 NiF2.4H2O NiHPO4 NiI2 NiI2.4H2O NiI2.6H2O NiMoO4
Common/IUPAC Name Nickel tri(ethylenediamine) ion (+2) Nickel mono(L-alpha-alanine) ion(+1) Nickel di(L-alpha-alanine) Nickel triethanolamine ion(+2) Nickel di(triethanolamine) ion(+2) Nickel citrate ion(-1) Nickel mono-NTA ion(-1) Nickel di-NTA ion(-4) Nickel dihydrogen DTPA ion(-1) Nickel dihydrogen citrate ion(+1) Nickel trihydrogen DTPA Nickel hydrogen EDTA ion(-1) Nickel hydrogen DTPA ion(-2) Nickel hydrogen citrate Nickel hydrogen NTA Nickel(II) monoformate ion(+1) Nickel(II) formate Nickel ion(+2) Dinickel DTPA ion(-1) Nickel orthophosphate Nickel(II) bromide Nickel(II) bromide hexahydrate Nickel(II) oxalate Nickel(II) oxalate dihydrate Nickel(II) monochloride ion(+1) Nickel(II) chloride Nickel(II) chloride dihydrate Nickel(II) chloride tetrahydrate Nickel(II) chloride hexahydrate Nickel(II) carbonate Nickel(II) monofluoride ion(+1) Nickel(II) fluoride Nickel(II) fluoride tetrahydrate Nickel(II) hydrogen orthophosphate Nickel(II) iodide Nickel(II) iodide tetrahydrate Nickel(II) iodide hexahydrate Nickel(II) molybdate(VI)
Aspen HYSYSOLI Interface Name NIEDA3ION NIALANION NIALAN2 NITEXHION NITEXH2ION NICTRTION NINTAION NINTA2ION NIH2DTPAION NIH2CTRTION NIH3DTPA NIHEDTAION NIHDTPAION NIHCTRT NIHNTA NICOOHION NICOOH2 NIION NI2DTPAION NI3PO42 NIBR2 NIBR2.6H2O NIC2O4 NIC2O4.2H2O NICLION NICL2 NICL2.2H2O NICL2.4H2O NICL2.6H2O NICO3 NIFION NIF2 NIF2.4H2O NIHPO4 NII2 NII2.4H2O NII2.6H2O NIMOO4
A-103
A-104
Formula NiNH3+2 NiNi(CN)4 NiNO3+1 NiOH+1 NiS NiSCN+1 NiSeCN+1 NiSeO3 NiSeO4 NiSeO4.4H2O NiSeO4.6H2O NiSO4 NiSO4.6H2O NiSO4.7H2O NiWO4 NO NO2 NO2-1 NO3-1 Np(CO3)5-6 Np(H2PO4)2+1 Np(H2PO4)3 Np(HPO4)2 Np(HPO4)3-2 Np(HPO4)4-4 Np(HPO4)5-6 Np(NO3)2+2 Np(NO3)3+1 Np(NO3)4 Np(OH)+3 Np(OH)2+2 Np(OH)3 Np(OH)3+1 Np(OH)4 Np(OH)5-1
Common/IUPAC Name Nickel(II) monoammonia ion(+2) Nickel(II) tetracyanonickel Nickel(II) nitrate ion(+1) Nickel(II) monohydroxide ion (+1) Nickel(II) sulfide Nickel(II) thiocyanate ion(+1) Nickel(II) selenocyanate ion(+1) Nickel(II) selenite(IV) Nickel(II) selenate(VI) Nickel(II) selenate(VI) tetrahydrate Nickel(II) selenate(VI) hexahydrate Nickel(II) sulfate Nickel(II) sulfate hexahydrate Nickel(II) sulfate heptahydrate Nickel(II) tungstate(VI) Nitric oxide Nitrogen dioxide Nitrite ion(-1) Nitrate ion(-1) Neptunium(IV) pentacarbonate ion(-6) Neptunium(III) di(dihydrogen orthophosphate) ion(+1) Neptunium(III) dihydrogen orthophosphate Neptunium(IV) hydrogen orthophosphate Neptunium(IV) tri(hydrogen orthophosphate) ion(-2) Neptunium(IV) tetra(hydrogen orthophosphate) ion(-4) Neptunium(IV) penta(hydrogen orthophosphate) ion(-6) Neptunium(IV) dinitrate ion(+2) Neptunium(IV) trinitrate ion(+1) Neptunium(IV) nitrate Neptunium(IV) monohydroxide ion(+3) Neptunium(IV) dihydroxide ion(+2) Neptunium(III) hydroxide Neptunium(IV) trihydroxide ion(+1) Neptunium(IV) hydroxide Neptunium(IV) pentahydroxide ion(-1)
Aspen HYSYSOLI Interface Name NINH3ION NINICN4 NINO3ION NIOHION NIS NISCNION NISECNION NISEO3 NISEO4 NISEO4.4H2O NISEO4.6H2O NISO4 NISO4.6H2O NISO4.7H2O NIWO4 NO NO2 NO2ION NO3ION NPIVCO35ION NPIIIH2PO42ION NPIIIH2PO43 NPIVHPO42 NPIVHPO43ION NPIVHPO44ION NPIVHPO45ION NPIVNO32ION NPIVNO33ION NPIVNO34 NPIVOHION NPIVOH2ION NPIIIOH3 NPIVOH3ION NPIVOH4 NPIVOH5ION
A-104
Formula Np(SO4)2 Np+3 Np+4 NpBr3 NpBr4 NpCl+3 NpCl2+2 NpCl3 NpCl4 NpF+3 NpF3 NpF4 NpF6 NpH2PO4+2 NpNO3+3 NpO2(C2O4)2-2 NpO2(C2O4)2-3 NpO2(CO3)2-2 NpO2(CO3)2-3 NpO2(CO3)3-4 NpO2(CO3)3-5 NpO2(OH)2 NpO2(SO4)2-2 NpO2[C10H12N2O8]-3 NpO2[C6H6NO6]-2 NpO2[H2C6H6NO6] NpO2[H3C10H12N2O8] NpO2[HC10H12N2O8]2 NpO2[HC6H6NO6]-1 NpO2+1 NpO2+2 NpO2C2O4 NpO2C2O4-1 NpO2Cl NpO2Cl+1
Common/IUPAC Name Neptunium(IV) sulfate Neptunium ion(+3) Neptunium ion(+4) Neptunium(III) bromide Neptunium(IV) bromide Neptunium(IV) monochloride ion(+3) Neptunium(IV) dichloride ion(+2) Neptunium(III) chloride Neptunium(IV) chloride Neptunium(IV) monofluoride ion(+3) Neptunium(III) fluoride Neptunium(IV) fluoride Neptunium(VI) fluoride Neptunium(III) dihydrogen orthophosphate ion(+2) Neptunium(IV) mononitrate ion(+3) Dioxoneptunium(VI) dioxalate ion(-2) Dioxoneptunium(V) dioxalate ion(-3) Dioxoneptunium dicarbonate ion(-2) Dioxoneptunium(V) dicarbonate ion(-3) Dioxoneptunium tricarbonate ion(-4) Dioxoneptunium(V) tricarbonate ion(-5) Dioxoneptunium(VI) hydroxide Dioxoneptunium(VI) disulfate ion(-2) Dioxoneptunium EDTA ion(-3) Dioxoneptunium(VI) NTA ion(-2) Dioxoneptunium(VI) dihydrogen NTA Dioxoneptunium(VI) trihydrogen EDTA Dioxoneptunium(VI) hydrogen EDTA ion(2) Dioxoneptunium(VI) hydrogen NTA ion(1) Dioxoneptunium(V) ion(+1) Dioxoneptunium(VI) ion(+2) Dioxoneptunium(VI) oxalate Dioxoneptunium(V) monooxalate ion(-1) Dioxoneptunium(V) chloride Dioxoneptunium(VI) monochloride ion(+1)
Aspen HYSYSOLI Interface Name NPIVSO42 NPIIIION NPIVION NPIIIBR3 NPIVBR4 NPIVCLION NPIVCL2ION NPIIICL3 NPIVCL4 NPIVFION NPIIIF3 NPIVF4 NPF6 NPIIIH2PO4ION NPIVNO3ION NPO2C2O42ION NPVO2C2O42ION NPO2CO32ION NPVO2CO32ION NPO2CO33ION NPVO2CO33ION NPO2OH2 NPO2SO42ION NPO2EDTAION NPO2NTAION NPO2H2NTA NPO2H3EDTA NPO2HEDTAION NPO2HNTAION NPVO2ION NPO2ION NPO2C2O4 NPVO2C2O4ION NPVO2CL NPO2CLION
A-105
A-106
Formula NpO2Cl2 NpO2CO3 NpO2CO3-1 NpO2F NpO2F+1 NPO2F2 NpO2H2PO4 NpO2H2PO4+1 NpO2HC2O4+1 NpO2HPO4 NpO2HPO4+2 NpO2HPO4-1 NpO2NO3+1 NpO2OH NpO2OH+1 NpO2SO4 NpO2SO4-1 NpOH+2 NpSO4+2 O2 O3 O3Te-2 OH-1 Os P P2O5 P2O7-4 Pb Pb(HCO3)2 PB(HS)2 PB(HSO3)2 Pb(HSO4)2 Pb(NH2CO2)2
Common/IUPAC Name Dioxoneptunium(VI) chloride Dioxoneptunium(VI) carbonate Dioxoneptunium(V) monocarbonate ion(1) Dioxoneptunium(V) fluoride Dioxoneptunium(VI) monofluoride ion(+1) Dioxoneptunium(VI) fluoride Dioxoneptunium(V) dihydrogen orthophosphate Dioxoneptunium(VI) dihydrogen orthophosphate ion(+1) Dioxoneptonium(VI) hydrogen oxalate ion(+1) Dioxoneptunium(VI) hydrogen orthophosphate Neptunium(IV) mono(hydrogen orthophosphate) ion(+2) Dioxoneptunium(V) hydrogen orthophosphate ion(-1) Dioxoneptunium(VI) mononitrate ion(+1) Dioxoneptunium(V) hydroxide Dioxoneptunium(VI) monohydroxide(+1) Dioxoneptunium(VI) sulfate Dioxoneptunium(V) sulfate ion(-1) Neptunium(III) monohydroxide ion(+2) Neptunium(IV) sulfate ion(+2) Oxygen Ozone Tellurate(IV) ion(-2) Hydroxide ion(-1) Osmium Phosphorus Phosphorus pentoxide Pyrophosphate ion(-4) Lead Lead(II) bicarbonate Lead(II) bisulfide Lead(II) bisulfite Lead bisulfate Lead(II) carbamate
Aspen HYSYSOLI Interface Name NPO2CL2 NPO2CO3 NPVO2CO3ION NPVO2F NPO2FION NPO2F2 NPVO2H2PO4 NPO2H2PO4ION NPO2HC2O4ION NPO2HPO4 NPIVHPO4ION NPVO2HPO4ION NPO2NO3ION NPVO2OH NPO2OHION NPO2SO4 NPVO2SO4ION NPIIIOHION NPIVSO4ION O2 OZONE TEIVO3ION OHION OSEL PEL P2O5 P2O7ION PBEL PBHCO32 PBHS2 PBHSO32 PBHSO42 PBNH2CO22
A-106
Formula Pb(NO2)2 Pb(NO2)3-1 Pb(NO3)2 Pb(NO3)3-1 Pb(OH)2 Pb(SCN)2 Pb(VO3)2 Pb[C10H12N2O8]-2 Pb[C14H18N3O10]-3 Pb[C2H3O2]+1 Pb[C2H3O2]2 Pb[C2H3O2]3-1 Pb[C2H3O3]+1 Pb[C2H3O3]2 Pb[C2H4NO2]+1 Pb[C2H4NO2]2 Pb[C2H7NO]+2 Pb[C2H8N2]+2 Pb[C2H8N2]2+2 Pb[C3H6NO2]+1 Pb[C3H6NO2]2 Pb[C4H4O6] Pb[C6H6NO6]-1 Pb[H2C10H12N2O8] Pb[H3C14H18N3O10] Pb[HC12N2O8]-1 Pb[HC14H18N3O10]-2 Pb[HC6H6NO6] Pb[HCOO]+1 Pb[HCOO]2 Pb+2 Pb2[C14H18N3O10]-1 Pb3(PO4)2 Pb3(VO4)2 PbBr+1 PbBr2 PbBr3-1 PbC2O4
Common/IUPAC Name Lead(II) nitrite Lead(II) trinitrite ion(-1) Lead(II) nitrate Lead(II) trinitrate ion(-1) Lead(II) hydroxide Lead(II) thiocyanate Lead(II) metavanadate Lead(II) EDTA ion(-2) Lead(II) DTPA ion(-3) Lead(II) monoacetate ion(+1) Lead(II) acetate Lead(II) triacetate ion(-1) Lead(II) monoglycolate ion(+1) Lead(II) diglycolate Lead(II) monoglycine ion(+1) Lead(II) diglycine Lead(II) mono(2-aminoethanol) ion(+2) Lead(II) monoethylenediamine ion(+2) Lead(II) di(ethylenediamine) ion(+2) Lead monoalanine ion(+1) Lead(II) alanine Lead(II) tartrate Lead(II) NTA ion(-1) Lead(II) dihydrogen EDTA Lead(II) trihydrogen DTPA Lead(II) hydrogen EDTA ion(-1) Lead(II) hydrogen DTPA ion(-2) Lead(III) hydrogen NTA Lead(II) monoformate ion(+1) Lead(II) formate Lead(II) ion(+2) Dilead(II) DTPA ion(-1) Lead(II) orthophosphate Lead(II) orthovanadate Lead(II) monobromide ion(+1) Lead(II) bromide Lead(II) tribromide ion(-1) Lead(II) oxalate
Aspen HYSYSOLI Interface Name PBNO22 PBNO23ION PBNO32 PBNO33ION PBOH2 PBSCN2 PBVO32 PBEDTAION PBDTPAION PBACETION PBACET2 PBACET3ION PBGLYCOLION PBGLYCOL2 PBGLYCINION PBGLYCIN2 PBMEXHION PBEDAION PBEDA2ION PBALANION PBALAN2 PBTARTRT PBNTAION PBH2EDTA PBH3DTPA PBHEDTAION PBHDTPAION PBHNTA PBCOOHION PBCOOH2 PBION PB2DTPAION PB3PO42 PB3VO42 PBBRION PBBR2 PBBR3ION PBC2O4
A-107
A-108
Formula PbCl+1 PbCl2 PbCl3-1 PbCl4-2 PbCO3 PbF+1 PbF2 PbF3-1 PbF4-2 PbH2PO4+1 PbHPO4 PbI+1 PbI2 PbI3-1 PbI4-2 PbMoO4 PbNO2+1 PbNO3+1 PbO PbOH+1 PbS PbSCN+1 PbSe PbSO3 PbSO4 PbWO4 Pd Pd(NH3)+2 Pd(NH3)2+2 Pd(NH3)3+2 Pd(NH3)4+2 Pd(OH)2 Pd(SO4)2-2 Pd(SO4)3-4 Pd[C2H3O2]+1 Pd[C2H3O2]2 Pd[C2H3O2]3-1 Pd[C2H4NO2]+1
Common/IUPAC Name Lead(II) monochloride ion(+1) Lead(II) chloride Lead(II) trichloride ion(-1) Lead(II) tetrachloride ion(-2) Lead(II) carbonate Lead(II) monofluoride ion(+1) Lead(II) fluoride Lead(II) trifluoride ion(-1) Lead(II) tetrafluoride ion(-2) Lead(II) dihydrogen orthophosphate ion(+1) Lead(II) hydrogen orthophosphate Lead(II) monoiodide ion(+1) Lead(II) iodide Lead(II) triiodide ion(-1) Lead(II) tetraiodide ion(-2) Lead(II) molybdate Lead(II) mononitrite ion(+1) Lead(II) mononitrate ion(+1) Lead(II) oxide Lead(II) monohydroxide ion(+1) Lead(II) sulfide Lead(II) thiocyanate ion(+1) Lead(II) selenide Lead(II) sulfite Lead(II) sulfate Lead(II) tungstate(VI) Palladium Palladium(II) monoammonia ion(+2) Palladium(II) diammonia ion(+2) Palladium(II) triammonia ion(+2) Palladium(II) tetraammonia ion(+2) Palladium(II) hydroxide Palladium(II) disulfate ion(-2) Palladium(II) trisulfate ion(-4) Palladium(II) monoacetate ion(+1) Palladium(II) acetate Palladium(II) triacetate ion(-1) Palladium(II) monoglycine ion(+1)
Aspen HYSYSOLI Interface Name PBCLION PBCL2 PBCL3ION PBCL4ION PBCO3 PBFION PBF2 PBF3ION PBF4ION PBH2PO4ION PBHPO4 PBIION PBI2 PBI3ION PBI4ION PBMOO4 PBNO2ION PBNO3ION PBO PBOHION PBS PBSCNION PBSE PBSO3 PBSO4 PBWO4 PDEL PDNH3ION PDNH32ION PDNH33ION PDNH34ION PDIIOH2 PDIISO42ION PDIISO43ION PDACETION PDACET2 PDACET3ION PDGLYCINION A-108
Formula Pd[C2H4NO2]2 Pd+2 PdCl+1 PdCl2 PdCl3-1 PdCl4-2 PdOH+1 PdS PdSO4 Pm PO4-3 Pr Pr(NO3)3 Pr(NO3)3.6H2O Pr(OH)[C6H6NO6]-1 Pr(OH)2+1 Pr(OH)3 Pr(OH)4-1 Pr(SO4)2-1 Pr[C10H12N2O8]-1 Pr[C14H18N3O10]-2 Pr[C2H3O2]+2 Pr[C2H3O2]2+1 Pr[C2H3O2]3 Pr[C4H4O6]+1 Pr[C6H5O7] Pr[C6H6NO6] Pr[C6H6NO6]2-3 Pr[H2C14H18N3O10] Pr[HC10H12N2O8] Pr[HC14H18N3O10]-1 Pr+3 Pr2(CO3)3 Pr2(SO4)3 Pr2(WO4)3 Pr2[C4H4O6]3 PrBr3
Common/IUPAC Name Palladium(II) diglycine Palladium ion(+2) Palladium(II) monochloride ion(+1) Palladium(II) chloride Palladium(II) trichloride ion(-1) Palladium(II) tetrachloride ion(-2) Palladium(II) monohydroxide ion(+1) Palladium(II) sulfide Palladium(II) sulfate Promethium Phosphate ion(-3) Praseodymium Praseodymium(III) nitrate Praseodymium(III) nitrate hexahydrate Praseodymium(III) hydroxide NTA ion(-1) Praseodymium(III) dihydroxide ion(+1) Praseodymium(III) hydroxide Praseodymium(III) tetrahydroxide ion(1) Praseodymium(III) disulfate ion(-1) Praseodymium(III) EDTA ion(-1) Praseodymium(III) DTPA ion(-2) Praseodymium(III) monoacetate ion(+2) Praseodymium(III) diacetate ion(+1) Praseodymium(III) acetate Praseodymium(III) tartrate ion(+1) Praseodymium(III) citrate Praseodymium(III) NTA Praseodymium(III) di-NTA ion(-3) Praseodymium(III) dihydrogen DTPA Praseodymium(III) hydrogen EDTA Praseodymium(III) hydrogen DTPA ion(1) Praseodymium ion(+3) Praseodymium(III) carbonate Praseodymium(III) sulfate Praseodymium(III) tungstate Praseodymium(III) tartrate Praseodymium(III) bromide
Aspen HYSYSOLI Interface Name PDGLYCIN2 PDIIION PDIICLION PDIICL2 PDIICL3ION PDIICL4ION PDIIOHION PDS PDIISO4 PMEL PO4ION PREL PRNO33 PRNO33.6H2O PROHNTAION PROH2ION PROH3 PROH4ION PRSO42ION PREDTAION PRDTPAION PRACETION PRACET2ION PRACET3 PRTRTRTION PRCTRT PRNTA PRNTA2ION PRH2DTPA PRHEDTA PRHDTPAION PRION PR2CO33 PR2SO43 PR2WO43 PR2TRTRT3 PRBR3
A-109
A-110
Formula PrCl+2 PrCl2+1 PrCl3 PrCl3.7H2O PrCl4-1 PrCO3+1 PrF+2 PrF2+1 PrF3 PrF4-1 PrH2PO4+2 PrHCO3+2 PrI3 PrNO3+2 PrOH+2 PrPO4 PrSO4+1 Pt Pt(NH3)4+2 Pt(OH)2 Pt(SO4)2-2 Pt(SO4)3-4 Pt[(NH3)6]+4 Pt[C2H3O2]+1 Pt[C2H3O2]2 Pt[C2H3O2]3-1 Pt[C2H4NO2]+1 Pt[C2H4NO2]2 Pt[H2C10H12N2O8] Pt[H3C10H12N2O8]+1 Pt[HC10H12N2O8]-1 Pt+2 Pt+4 PtCl+1 PtCl+3 PtCl2 PtCl2+2
Common/IUPAC Name Praseodymium(III) monochloride ion(+2) Praseodymium(III) dichloride ion(+1) Praseodymium(III) chloride Praseodymium(III) chloride heptahydrate Praseodymium(III) tetrachloride ion(-1) Praseodymium(III) carbonate ion(+1) Praseodymium(III) monofluoride ion(+2) Praseodymium(III) difluoride ion(+1) Praseodymium(III) fluoride Praseodymium(III) tetrafluoride ion(-1) Praseodymium(III) dihydrogen orthophosphate ion(+2) Praseodymium(III) bicarbonate ion(+2) Praseodymium(III) iodide Praseodymium(III) mononitrate ion(+2) Praseodymium(III) monohydroxide ion(+2) Praseodymium(III) orthophosphate Praseodymium(III) sulfate ion(+1) Platinum Platinum(II) tetraammonia ion(+2) Platinum(II) hydroxide Platinum(II) disulfate ion(-2) Platinum(II) trisulfate ion(-4) Platinum(IV) hexaammonia ion(+4) Platinum(II) monoacetate ion(+1) Platinum(II) acetate Platinum(II) triacetate ion(-1) Platinum(II) monoglycine ion(+1) Platinum(II) diglycine Platinum(II) dihydrogen EDTA Platinum(II) trihydrogen EDTA ion(+1) Platinum(II) hydrogen EDTA ion(-1) Platinum ion(+2) Platinum ion(+4) Platinum(II) monochloride ion(+1) Platinum(IV) monochloride ion(+3) Platinum(II) chloride Platinum(IV) dichloride ion(+2)
Aspen HYSYSOLI Interface Name PRCLION PRCL2ION PRCL3 PRCL3.7H2O PRCL4ION PRCO3ION PRFION PRF2ION PRF3 PRF4ION PRH2PO4ION PRHCO3ION PRI3 PRNO3ION PROHION PRPO4 PRSO4ION PTEL PTIINH34ION PTIIOH2 PTIISO42ION PTIISO43ION PTIVNH36ION PTACETION PTACET2 PTACET3ION PTGLYCINION PTGLYCIN2 PTH2EDTA PTH3EDTAION PTHEDTAION PTIIION PTIVION PTIICLION PTIVCLION PTIICL2 PTIVCL2ION
A-110
Formula PtCl3+1 PtCl3-1 PtCl4 PtCl4-2 PtCl5-1 PtCl6-2 PtOH+1 PtS PtSO4 Pu Pu(C2O4)2 Pu(C2O4)3-2 Pu(C2O4)4-4 Pu(CO3)2 Pu(HPO4)2 Pu(NO3)2+2 Pu(NO3)3+1 Pu(NO3)4 Pu(OH)2+2 Pu(OH)3 Pu(OH)3+1 Pu(OH)4 Pu(SO4)2 Pu[C10H12N2O8] Pu[C6H5O7]+1 Pu+3 Pu+4 Pu2(SO4)3 Pu2O3 PuC2O4+2 PuCl+3 PuCl2+2 PuCl3 PuCl3.6H2O PuCl3+1 PuCl4 PuCO3+2 PuCO3-1
Common/IUPAC Name Platinum(IV) trichloride ion(+1) Platinum(II) trichloride ion(-1) Platinum(IV) chloride Platinum(II) tetrachloride ion(-2) Platinum(IV) pentachloride ion(-1) Platinum(IV) hexachloride ion(-2) Platinum(II) monohydroxide ion(+1) Platinum(II) sulfide Platinum(II) sulfate Plutonium Plutonium(IV) oxalate Plutonium(IV) trioxalate ion(-2) Plutonium(VI) tetraoxalate ion(-4) Plutonium(IV) carbonate Plutonium(IV) hydrogen orthophosphate Plutonium(IV) dinitrate ion(+2) Plutonium(IV) trinitrate ion(+1) Plutonium(IV) nitrate Plutonium(IV) dihydroxide ion(+2) Plutonium(III) hydroxide Plutonium(IV) trihydroxide ion(+1) Plutonium(IV) hydroxide Plutonium(IV) sulfate Plutonium(IV) EDTA Plutonium(IV) citrate ion(+1) Plutonium ion(+3) Plutonium ion(+4) Plutonium(III) sulfate Plutonium(III) oxide Plutonium(IV) monooxalate ion(+2) Plutonium(IV) monochloride ion(+3) Plutonium(IV) dichloride ion(+2) Plutonium(III) chloride Plutonium(III) chloride hexahydrate Plutonium(IV) trichloride ion(+1) Plutonium(IV) chloride Plutonium(IV) carbonate ion(+2) Dioxyplutonium(V) carbonate ion(-1)
Aspen HYSYSOLI Interface Name PTIVCL3ION PTIICL3ION PTIVCL4 PTIICL4ION PTIVCL5ION PTIVCL6ION PTIIOHION PTS PTIISO4 PUEL PUIVC2O42 PUIVC2O43ION PUIVC2O44ION PUIVCO32 PUIVHPO42 PUIVNO32ION PUIVNO33ION PUIVNO34 PUIVOH2ION PUIIIOH3 PUIVOH3ION PUIVOH4 PUIVSO42 PUIVEDTA PUIVCITRATION PUIIIION PUIVION PUIII2SO43 PU2O3 PUIVC2O4ION PUIVCLION PUIVCL2ION PUIIICL3 PUIIICL3.6H2O PUIVCL3ION PUIVCL4 PUIVCO3ION PUVO2CO3ION
A-111
A-112
Formula PuF2+2 PuF3 PuF3+1 PuF3+3 PuF4 PuF6 PuHPO4 PuI3 PuNO3+3 PuO2(C2O4)2-2 PuO2(C2O4)2-3 PuO2(CO3)2-2 PuO2(CO3)3-4 PuO2(NO3)2 PuO2(OH)+1 PuO2(OH)2 PuO2(SO4)2-2 PuO2[C10H12N2O8]-2 PuO2[C10H13N2O8]-2 PuO2[C2H3O3]+1 PuO2[C2H3O3]2 PuO2[C2H3O3]3-1 PuO2[C6H6NO6]-2 PuO2[H2C6H6NO6] PuO2[H3C10H12N2O8] PuO2[HC10H12N2O8]2 PuO2+1 PuO2+2 PuO2C2O4 PuO2C2O4-1 PuO2Cl PuO2Cl+1 PuO2Cl2 PuO2CO3
Common/IUPAC Name Plutonium(IV) difluoride ion(+2) Plutonium(III) fluoride Plutonium(IV) trifluoride ion(+1) Plutonium(IV) monofluoride ion(+3) Plutonium(IV) fluoride Plutonium(VI) fluoride Dioxyplutonium(VI) hydrogen orthophosphate Plutonium(III) iodide Plutonium(IV) mononitrate ion(+3) Dioxyplutonium(VI) dioxalate ion(-2) Dioxyplutonium(V) dioxalate ion(-3) Dioxyplutonium(VI) dicarbonate ion(-2) Dioxyplutonium(VI) tricarbonate ion(-4) Dioxyplutonium(VI) nitrate Dioxyplutonium(VI) monohydroxide ion(+1) Dioxyplutonium(VI) hydroxide Dioxyplutonium(VI) disulfate ion(-2) Dioxyplutonium(VI) EDTA ion(-2) Dioxyplutonium(V) hydrogen EDTA ion(2) Dioxyplutonium(VI) monoglycolate ion(+1) Dioxyplutonium(VI) glycolate Dioxyplutonium(VI) triglycolate ion(-1) Dioxyplutonium(VI) NTA ion(-2) Dioxyplutonium(VI) dihydrogen NTA Dioxyplutonium(VI) trihydrogen EDTA Dioxyplutonium(VI) hydrogen EDTA ion(2) Dioxyplutonium(V) ion(+1) Dioxyplutonium(VI) ion(+2) Dioxyplutonium(VI) oxalate Dioxyplutonium(V) monooxalate ion(-1) Dioxyplutonium(V) chloride Dioxyplutonium(VI) monochloride ion(+1) Dioxyplutonium(VI) chloride Dioxyplutonium(VI) carbonate
Aspen HYSYSOLI Interface Name PUIVF2ION PUIIIF3 PUIVF3ION PUIVFION PUIVF4 PUF6 PUO2HPO4 PUIIII3 PUIVNO3ION PUO2C2O42ION PUVO2C2O42ION PUO2CO32ION PUO2CO33ION PUO2NO32 PUO2OHION PUO2OH2 PUO2SO42ION PUO2EDTAION PUVO2HEDTAION PUO2GLYCOLION PUO2GLYCOL2 PUO2GLYCOL3ION PUO2NTAION PUO2H2NTA PUO2H3EDTA PUO2HEDTAION PUVO2ION PUO2ION PUO2C2O4 PUVO2C2O4ION PUVO2CL PUO2CLION PUO2CL2 PUO2CO3
A-112
Formula PuO2F PuO2F+1 PuO2F2 PuO2F3-1 PuO2F4-2 PuO2NO3 PuO2NO3+1 PuO2OH PuO2SO4-1 PuOH+3 PuPO4 PuSO4 PuSO4+1 PuSO4+2 Ra Ra(IO3)2 Ra(IO3)2.H2O Ra(NO3)2 Ra(OH)2 Ra[C10H12N2O8]-2 Ra[C10H14N2O8] Ra[C2H3O2]+1 Ra[C2H3O2]2 Ra[C2H3O3]+1 Ra[C2H3O3]2 Ra[C2H4NO2]+1 Ra[C2H4NO2]2 Ra[C4H4O6] Ra+2 Ra3(PO4)2 RaBr2 RaBr2.2H2O RaCl+1 RaCl2 RaCl2.2H2O RaCO3 RaF+1 RaF2
Common/IUPAC Name Dioxyplutonium(V) fluoride Dioxyplutonium(VI) monofluoride ion(+1) Dioxyplutonium(VI) fluoride Dioxyplutonium(VI) trifluoride ion(-1) Dioxyplutonium(VI) tetrafluoride ion(-2) Dioxyplutonium(V) nitrate Dioxyplutonium(VI) mononitrate ion(+1) Dioxyplutonium(V) hydroxide Dioxyplutonium(V) sulfate ion(-1) Plutonium(IV) monohydroxide ion(+3) Lutetium(III) orthophosphate Dioxyplutonium(VI) sulfate Plutonium(III) sulfate ion(+1) Plutonium(IV) monosulfate ion(+2) Radium Radium iodate Radium iodate monohydrate Radium nitrate Radium hydroxide Radium EDTA ion(-2) Radium dihydrogen EDTA Radium monoacetate ion(+1) Radium acetate Radium monoglycolate ion(+1) Radium glycolate Radium monoglycine ion(+1) Radium diglycine Radium tartrate Radium ion(+2) Radium phosphate Radium bromide Radium bromide dihydrate Radium monochloride ion(+1) Radium chloride Radium chloride dihydrate Radium carbonate Radium monofluoride ion(+1) Radium fluoride
Aspen HYSYSOLI Interface Name PUVO2F PUO2FION PUO2F2 PUO2F3ION PUO2F4ION PUVO2NO3 PUO2NO3ION PUVO2OH PUVO2SO4ION PUIVOHION LUPO4 PUO2SO4 PUIIISO4ION PUIVSO4ION RAEL RAIO32 RAIO32.1H2O RANO32 RAOH2 RAEDTAION RAH2EDTA RAACETION RAACET2 RAGLYCOLION RAGLYCOL2 RAGLYCINION RAGLYCIN2 RATARTRT RAION RA3PO42 RABR2 RABR2.2H2O RACLION RACL2 RACL2.2H2O RACO3 RAFION RAF2
A-113
A-114
Formula RaI+1 RaI2 RaI2.0.5H2O RaNO3+1 RaOH+1 RaS RaSe RaSeO3 RaSeO4 RaSO3 RaSO4 Rb Rb[B(C6H5)4] Rb[C2H3O2] Rb[C2H3O3] Rb[C2H3O3]2-1 Rb[C6H5O7]-2 Rb[H2C6H5O7] Rb+1 Rb2CO3 Rb2CO3.1.5H2O Rb2CO3.1H2O Rb2CO3.3.5H2O Rb2CrO4 Rb2MoO4 Rb2SeO3 Rb2SeO4 Rb2SO4 Rb2WO4 RbBO2 RbBr RbCl RbF RbF.1H2O RbH2PO4 RbHF2 RbI RbNbO3
Common/IUPAC Name Radium monoiodide ion(+1) Radium iodide Radium iodide hemihydrate Radium mononitrate ion(+1) Radium monohydroxide ion(+1) Radium sulfide Radium selenide Radium selenite Radium selenate Radium sulfite Radium sulfate Rubidium Rubidium tetraphenylborate Rubidium acetate Rubidium glycolate Rubidium diglycolate ion(-1) Rubidium citrate ion(-2) Rubidium dihydrogen citrate Rubidium ion(+1) Rubidium carbonate Rubidium carbonate 1.5 hydrate Rubidium carbonate monohydrate Rubidium carbonate 3.5 hydrate Rubidium chromate(VI) Rubidium molybdate(VI) Rubidium selenite Rubidium selenate Rubidium sulfate Rubidium tungstate(VI) Rubidium metaborate Rubidium bromide Rubidium chloride Rubidium fluoride Rubidium fluoride monohydrate Rubidium dihydrogen orthophosphate Rubidium hydrogen difluoride Rubidium iodide Rubidium niobate
Aspen HYSYSOLI Interface Name RAIION RAI2 RAI2.0.5H2O RANO3ION RAOHION RAS RASE RASEO3 RASEO4 RASO3 RASO4 RBEL RBBPH4 RBACET RBGLYCOL RBGLYCOL2ION RBCTRTION RBH2CTRT RBION RB2CO3 RB2CO3.1.5H2O RB2CO3.1H2O RB2CO3.3.5H2O RB2CRO4 RB2MOO4 RB2SEO3 RB2SEO4 RB2SO4 RB2WO4 RBBO2 RBBR RBCL RBF RBF.1H2O RBH2PO4 RBHF2 RBI RBNBO3
A-114
Formula RbNO2 RbNO3 RbOH RbOH.1H2O RbOH.2H2O RbSO4-1 RbTaO3 Re ReO4-1 Rh(OH)2 Rh(OH)2+1 Rh(OH)3 Rh(SO4)2-1 Rh(SO4)2-2 Rh(SO4)3-3 Rh(SO4)3-4 Rh[C2H3O2]+1 Rh[C2H3O2]2 Rh[C2H3O2]3-1 Rh[C2H4NO2]+1 Rh[C2H4NO2]2 Rh+2 Rh+3 Rh2(SO4)3 Rh2O3 RhCl+1 RhCl+2 RhCl2 RhCl2+1 RhCl3 RhCl3-1 RhCl4-1 RhCl4-2 RhOH+1 RhOH+2 RhSO4 RhSO4+1 Rn
Common/IUPAC Name Rubidium nitrite Rubidium nitrate Rubidium hydroxide Rubidium hydroxide monohydrate Rubidium hydroxide dihydrate Rubidium sulfate ion(-1) Rubidium tantalate Rhenium Rhenate(VII) ion(-1) Rhodium(II) hydroxide Rhodium(III) dihydroxide ion(+1) Rhodium(III) hydroxide Rhodium(III) disulfate ion(-1) Rhodium(II) disulfate ion(-2) Rhodium(III) trisulfate ion(-3) Rhodium(II) trisulfate ion(-4) Rhodium(II) monoacetate ion(+1) Rhodium(II) acetate Rhodium(II) triacetate ion(-1) Rhodium(II) monoglycine ion(+1) Rhodium(II) glycine Rhodium(III) ion(+2) Rhodium ion(+3) Rhodium(III) sulfate Rhodium(III) oxide Rhodium(II) monochloride ion(+1) Rhodium(III) monochloride ion(+2) Rhodium(II) chloride Rhodium(III) dichloride ion(+1) Rhodium(III) chloride Rhodium(II) trichloride ion(-1) Rhodium(III) tetrachloride ion(-1) Rhodium(II) tetrachloride ion(-2) Rhodium(II) monohydroxide ion(+1) Rhodium(III) monohydroxide ion(+2) Rhodium(II) sulfate Rhodium(III) monosulfate ion(+1) Radon
Aspen HYSYSOLI Interface Name RBNO2 RBNO3 RBOH RBOH.1H2O RBOH.2H2O RBSO4ION RBTAO3 REEL REO4ION RHIIOH2 RHIIIOH2ION RHIIIOH3 RHIIISO42ION RHIISO42ION RHIIISO43ION RHIISO43ION RHACETION RHACET2 RHACET3ION RHGLYCINION RHGLYCIN2 RHIIION RHIIIION RHIII2SO43 RH2O3 RHIICLION RHIIICLION RHIICL2 RHIIICL2ION RHIIICL3 RHIICL3ION RHIIICL4ION RHIICL4ION RHIIOHION RHIIIOHION RHIISO4 RHIIISO4ION RN
A-115
A-116
Formula Ru Ru(OH)2 Ru(OH)2+1 Ru(OH)3 Ru(SO4)2-1 Ru(SO4)2-2 Ru(SO4)3-3 Ru(SO4)3-4 Ru[C2H3O2]+1 Ru[C2H3O2]2 Ru[C2H3O2]3-1 Ru[C2H4NO2]+1 Ru[C2H4NO2]2 Ru+2 Ru+3 Ru2(SO4)3 RuCl+1 RuCl+2 RuCl2 RuCl2+1 RuCl3 RuCl3-1 RuCl4-1 RuCl4-2 RuCl5-2 RuCl6-3 RuOH+1 RuOH+2 RuSO4 RuSO4+1 S-2 S2-2 S2O3-2 S2O4-2 S2O5-2 S2O6-2 S2O8-2 S3-2
Common/IUPAC Name Ruthenium Ruthenium(II) hydroxide Ruthenium(III) dihydroxide ion(+1) Ruthenium(III) hydroxide Ruthenium(III) disulfate ion(-1) Ruthenium(II) disulfate ion(-2) Ruthenium(III) trisulfate ion(-3) Ruthenium(II) trisulfate ion(-4) Ruthenium(II) monoacetate ion(+1) Ruthenium(II) acetate Ruthenium(II) triacetate ion(-1) Ruthenium(II) monoglycine ion(+1) Ruthenium(II) glycine Ruthenium ion(+2) Ruthenium ion(+3) Ruthenium(III) sulfate Ruthenium(II) monochloride ion(+1) Ruthenium(III) monochloride ion(+2) Ruthenium(II) chloride Ruthenium(III) dichloride ion(+1) Ruthenium(III) chloride Ruthenium(II) trichloride ion(-1) Ruthenium(III) tetrachloride ion(-1) Ruthenium(II) tetrachloride ion(-2) Ruthenium(III) pentachloride ion(-2) Ruthenium(III) hexachloride ion(-3) Ruthenium(II) monohydroxide ion(+1) Ruthenium(III) monohydroxide ion(+2) Ruthenium(II) sulfate Ruthenium(III) monosulfate ion(+1) Sulfide ion(-2) Disulfide ion(-2) Thiosulfite(II) ion(-2) Thiosulfate(III) ion(-2) Orthosulfate(IV) ion(-2) Metasulfate(V) ion(-2) Parasulfate(VII) ion(-2) Trisulfide ion(-2)
Aspen HYSYSOLI Interface Name RUEL RUIIOH2 RUIIIOH2ION RUIIIOH3 RUIIISO42ION RUIISO42ION RUIIISO43ION RUIISO43ION RUACETION RUACET2 RUACET3ION RUGLYCINION RUGLYCIN2 RUIIION RUIIIION RUIII2SO43 RUIICLION RUIIICLION RUIICL2 RUIIICL2ION RUIIICL3 RUIICL3ION RUIIICL4ION RUIICL4ION RUIIICL5ION RUIIICL6ION RUIIOHION RUIIIOHION RUIISO4 RUIIISO4ION SION S2ION S2O3ION S2O4ION S2O5ION S2O6ION S2O8ION S3ION
A-116
Formula S4-2 S5-2 S5O6-2 S8 Sb Sb(OH)2+1 Sb(OH)3 Sb(OH)4-1 Sb(OH)5 Sb(OH)6-1 Sb2(SO4)3 Sb2O3 Sb2O5 Sb2S3 Sb2Se3 SbBr3 SbCl3 SbF3 SbI3 Sc Sc(OH)3 Sc+3 SCN-1 Se Se-2 SeCN-1 SeO2 SeO3-2 SeO4-2 SF6 Si SiCl4 SiF4 SiF6-2 SiO2 Sm Sm(NO3)3 Sm(NO3)3.6H2O
Common/IUPAC Name Tetrasulfide ion(-2) Pentasulfide ion(-2) Pentasulfate(II) ion(-2) Sulfur Antimony Antimony(III) dihydroxide ion(+1) Antimony(III) hydroxide Antimony(III) tetrahydroxide ion(-1) Antimony(V) hydroxide Antimony(V) hexahydroxide ion(-1) Antimony(III) sulfate Antimony(III) oxide Antimony(V) oxide Antimony(III) sulfide Antimony(III) selenide Antimony(III) bromide Antimony(III) chloride Antimony(III) fluoride Antimony(III) iodide Scandium Scandium hydroxide Scandium ion(+3) Thiocyanate ion(-1) Selenium Selenide ion(-2) Selenocianate ion(-1) Selenium dioxide Selenite ion(-2) Selenate ion(-2) Sulfur hexafluoride Silicon Silicon tetrachloride Tetrafluorosilane Hexafluorosilicon ion(-2) Silicon dioxide (amorphous) Samarium Samarium(III) nitrate Samarium(III) nitrate hexahydrate
Aspen HYSYSOLI Interface Name S4ION S5ION S5O6ION SULFUREL SBEL SBOH2ION SBOH3 SBOH4ION SBOH5 SBOH6ION SB2SO43 SB2O3 SB2O5 SB2S3 SB2SE3 SBBR3 SBCL3 SBF3 SBI3 SCEL SCOH3 SCION SCNION SEEL SEION SECNION SEO2 SEO3ION SEO4ION SF6 SIEL SICL4 SIF4 SIF6ION SIO2 SMEL SMNO33 SMNO33.6H2O
A-117
A-118
Formula Sm(OH)[C6H6NO6]-1 Sm(OH)2 Sm(OH)2+1 Sm(OH)3 Sm(OH)4-1 Sm(SO4)2-1 Sm[C10H12N2O8]-1 Sm[C14H18N3O10]-2 Sm[C2H3O2]+2 Sm[C2H3O2]2+1 Sm[C2H3O2]3 Sm[C4H4O6]+1 Sm[C6H5O7] Sm[C6H6NO6] Sm[C6H6NO6]2-3 Sm[H2C14H18N3O10] Sm[HC10H12N2O8] Sm[HC14H18N3O10]-1 Sm+2 SM+3 Sm2(CO3)3 Sm2(SeO4)3 Sm2(SeO4)3.8H2O Sm2(SO4)3 Sm2(SO4)3.8H2O Sm2(WO4)3 Sm2[C4H4O6]3 SmCl+2 SmCl2+1 SmCl3 SmCl3.6H2O SmCl4-1 SmCO3+1 SmF+2 SmF2+1 SmF3 SmF4-1
Common/IUPAC Name Samarium(III) monohydroxide NTA ion(1) Samarium(II) hydroxide Samarium(III) dihydroxide ion(+1) Samarium(III) hydroxide Samarium(III) tetrahydroxide ion(-1) Samarium(III) disulfate ion(-1) Samarium(III) EDTA ion(-1) Samarium(III) DTPA ion(-2) Samarium(III) monoacetate ion(+2) Samarium(III) diacetate ion(+1) Samarium(III) acetate Samarium(III) tartrate ion(+1) Samarium(III) citrate Samarium(III) NTA Samarium(III) di-NTA ion(-3) Samarium(III) dihydrogen DTPA Samarium(III) hydrogen EDTA Samarium hydrogen DTPA ion(-1) Samarium ion(+2) Samarium ion(+3) Samarium(III) carbonate Samarium(III) selenate Samarium(III) selenate octahydrate Samarium(III) sulfate Samarium(III) sulfate octahydrate Samarium(III) tungstate Samarium(III) tartrate Samarium(III) monochloride ion(+2) Samarium(III) dichloride ion(+1) Samarium(III) chloride Samarium(III) chloride hexahydrate Samarium(III) tetrachloride ion(-1) Samarium(III) carbonate ion(+1) Samarium(III) monofluoride ion(+2) Samarium difluoride ion(+1) Samarium(III) fluoride Samarium(III) tetrafluoride ion(-1)
Aspen HYSYSOLI Interface Name SMOHNTAION SMIIOH2 SMOH2ION SMOH3 SMOH4ION SMSO42ION SMEDTAION SMDTPAION SMACETION SMACET2ION SMACET3 SMTRTRTION SMCTRT SMNTA SMNTA2ION SMH2DTPA SMHEDTA SMHDTPAION SMIIION SMIIIION SM2CO33 SMSEO43 SMSEO43.8H2O SM2SO43 SM2SO43.8H2O SM2WO43 SM2TRTRT3 SMCLION SMCL2ION SMCL3 SMCL3.6H2O SMCL4ION SMCO3ION SMFION SMF2ION SMF3 SMF4ION
A-118
Formula SmH2PO4+2 SmHCO3+2 SmNO3+2 SmOH+2 SmPO4 SmPO4.2H2O SmSO4+1 Sn Sn(CN)2 Sn(OH)2 Sn(OH)2+2 Sn(OH)3+1 Sn(OH)3-1 Sn(OH)4 Sn(OH)5-1 Sn(OH)6-2 Sn(SCN)2 Sn(SCN)3-1 Sn[C4H4O6] Sn+2 Sn+4 SnBr+1 SnBr2 SnBr3-1 SnBr4 SnCl+1 SnCl+3 SnCl2 SnCl2+2 SnCl3+1 SnCl3-1 SnCl4 SnCl4-2 SnCl5-1 SnF+1 SnF2 SnI2 SnI4
Common/IUPAC Name Samarium(III) dihydrogen orthophosphate ion(+2) Samarium(III) bicarbonate ion(+2) Samarium(III) mononitrate ion(+2) Samarium(III) monohydroxide ion(+2) Samarium(III) orthophosphate Samarium(III) phosphate dihydrate Samarium(III) monosulfate ion(+1) Tin Tin(II) cyanide Tin(II) hydroxide Tin(IV) dihydroxide ion(+2) Tin(IV) trihydroxide ion(+1) Tin(II) trihydroxide ion(-1) Tin(IV) hydroxide Tin(IV) pentahydroxide ion(-1) Tin(IV) hexahydroxide ion(-2) Tin(II) thiocyanate Tin(II) trithiocyanate ion(-1) Tin(II) tartrate Tin ion(+2) Tin ion(+4) Tin(II) monobromide ion(+1) Tin(II) bromide Tin(II) tribromide ion(-1) Tin(IV) bromide Tin(II) monochloride(+1) Tin(IV) monochloride ion(+3) Tin(II) chloride Tin(IV) dichloride ion(+2) Tin(IV) trichloride ion(+1) Tin(II) trichloride ion(-1) Tin(IV) chloride Tin(II) tetrachloride ion(-2) Tin(IV) pentachloride ion(-1) Tin(II) monofluoride ion(+1) Tin(II) fluoride Tin(II) iodide Tin(IV) iodide
Aspen HYSYSOLI Interface Name SMH2PO4ION SMHCO3ION SMNO3ION SMOHION SMPO4 SMPO4.2H2O SMSO4ION SNEL SNCN2 SNOH2 SNIVOH2ION SNIVOH3ION SNOH3ION SNIVOH4 SNIVOH5ION SNIVOH6ION SNSCN2 SNSCN3ION SNTARTRT SNION SNIVION SNBRION SNBR2 SNBR3ION SNIVBR4 SNCLION SNIVCLION SNCL2 SNIVCL2ION SNIVCL3ION SNCL3ION SNIVCL4 SNCL4ION SNIVCL5ION SNFION SNF2 SNI2 SNIVI4 A-119
A-120
Formula SnMoO4 SnOH+1 SnOH+3 SnSCN+1 SnWO4 SO2 SO3 SO3-2 SO4-2 Sr Sr(C2H3O2)2 Sr(CN)2 Sr(CN)2.4H2O Sr(H2PO4)2 Sr(HC2O4)2 Sr(HCO3)2 Sr(HS)2 Sr(HSO3)2 Sr(HSO4)2 Sr(NH2CO2)2 Sr(NO2)2 Sr(NO2)2.1H2O Sr(NO3)2 Sr(NO3)2.4H2O Sr(OH)2 Sr(OH)2.8H2O Sr(OH)2.H2O Sr[C10H12N2O8]-2 Sr[C10H14N2O8] Sr[C14H18N3O10]-3 Sr[C2H2O3]+1 Sr[C2H3O2]+1 Sr[C2H3O2]2.0.5H2O Sr[C2H3O2]2.4H2O Sr[C2H3O3]2 Sr[C2H4NO2]+1 Sr[C2H4NO2]2 Sr[C3H6NO2]+1
Common/IUPAC Name Tin(II) molybdate(VI) Tin(II) monohydroxide ion(+1) Tin(IV) monohydroxide ion(+3) Tin(II) monothiocyanate ion(+1) Tin(II) tungstate(VI) Sulfur dioxide Sulfur trioxide Sulfite ion(-2) Sulfate ion(-2) Strontium Strontium acetate Strontium cyanide Strontium cyanide tetrahydrate Strontiom dihydrogen orthophosphate Strontium hydrogen oxalate Strontium bicarbonate Strontium bisulfide Strontium bisulfite Strontium bisulfate Strontium carbamate Strontium nitrite Strontium nitrite monohydrate Strontium nitrate Strontium nitrate tetrahydrate Strontium hydroxide Strontium hydroxide octahydrate Strontium hydroxide monohydrate Strontium EDTA ion(-2) Strontium dihydrogen EDTA Strontium DTPA ion(-3) Strontium monoglycolate ion(+1) Strontium monoacetate ion(+1) Strontium acetate hemihydrate Strontium acetate tetrahydrate Strontium diglycolate Strontium monoglycine ion(+1) Strontium diglycine Strontium monoalanate ion(+1)
Aspen HYSYSOLI Interface Name SNMOO4 SNOHION SNIVOHION SNSCNION SNWO4 SO2 SO3 SO3ION SO4ION SREL SRAC2 SRCN2 SRCN2.4H2O SRH2PO42 SRHC2O42 SRHCO32 SRHS2 SRHSO32 SRHSO42 SRNH2CO22 SRNO22 SRNO22.1H2O SRNO32 SRNO32.4H2O SROH2 SROH2.8H2O SROH2.1H2O SREDTAION SRH2EDTA SRDTPAION SRGLYCOLION SRACETION SRAC2.0.5H2O SRAC2.4H2O SRGLYCOL2 SRGLYCINION SRGLYCIN2 SRALANION
A-120
Formula Sr[C3H6NO2]2 Sr[C4H4O6] Sr[C6H5O7]-1 Sr[C6H6NO6]-1 Sr[H3C14H18N3O10] Sr[HC10H12N2O8]-1 Sr[HC14H18N3O10]-2 Sr[HC4H4O6]+1 Sr[HC6H5O7] Sr[HC6H6NO6] Sr[HCOO]+1 Sr[HCOO]2 Sr+2 Sr3(AsO4)2 Sr3(PO4)2 SrBr2 SrBr2.6H2O SrC2O4 SrC2O4.1H2O SrCl2 SrCl2.1H2O SrCl2.2H2O SrCl2.6H2O SrCO3 SrCrO4 SrF+1 SrF2 SrHC2O4+1 SrHPO4 SrI2 SrI2.2H2O SrI2.6H2O SrMoO4 SrNO3+1 SrOH+1 SrPO4-1 SrS SrSeO4
Common/IUPAC Name Strontium alanate Strontium tartrate Strontium monocitrate ion(-1) Strontium NTA ion(-1) Strontium trihydrogen DTPA Strontium hydrogen EDTA ion(-1) Strontium hydrogen DTPA ion(-2) Strontium hydrogen tartrate ion(+1) Strontium hydrogen citrate Strontium hydrogen NTA Strontium monoformate ion(+1) Strontium formate Strontium ion(+2) Strontium arsenate Strontium orthophosphate Strontium bromide Strontium bromide hexahydrate Strontium oxalate Strontium oxalate monohydrate Strontium chloride Strontium chloride monohydrate Strontium chloride dihydrate Strontium chloride hexahydrate Strontium carbonate Strontium chromate Strontium monofluoride(+1) Strontium fluoride Strontium mono(hydrogen oxalate) ion(+1) Strontium hydrogen orthophosphate Strontium iodide Strontium iodide dihydrate Strontium iodide hexahydrate Strontium molybdate(VI) Strontium mononitrate ion(+1) Strontium monohydroxide ion(+1) Strontium orthophosphate ion(-1) Strontium sulfide Strontium selenate
Aspen HYSYSOLI Interface Name SRALAN2 SRTRTRT SRCTRTION SRNTAION SRH3DTPA SRHEDTAION SRHDTPAION SRHTARTRTION SRHCTRT SRHNTA SRCOOHION SRCOOH2 SRION SR3ASO42 SR3PO42 SRBR2 SRBR2.6H2O SRC2O4 SRC2O4.1H2O SRCL2 SRCL2.1H2O SRCL2.2H2O SRCL2.6H2O SRCO3 SRCRO4 SRFION SRF2 SRHC2O4ION SRHPO4 SRI2 SRI2.2H2O SRI2.6H2O SRMOO4 SRNO3ION SROHION SRPO4ION SRS SRSEO4 A-121
A-122
Formula SrSO3 SrSO4 SrWO4 Ta Ta2O5 TaBr5 TaCl5 TaF5 TaO3-1 Tb Tb(NO3)3 Tb(OH)[C6H6NO6]-1 Tb(OH)2+1 Tb(OH)3 Tb(OH)4-1 Tb(SO4)2-1 Tb[C10H12N2O8]-1 Tb[C14H18N3O10]-2 Tb[C2H3O2]+2 Tb[C2H3O2]2+1 Tb[C2H3O2]3 Tb[C2O4]+1 Tb[C2O4]2-1 Tb[C4H4O6]+1 Tb[C6H5O7] Tb[C6H6NO6] Tb[C6H6NO6]2-3 Tb[H2C14H18N3O10] Tb[HC10H12N2O8] Tb+2 Tb+3 Tb2(CO3)3 Tb2(SO4)3 Tb2(SO4)3.8H2O Tb2[C2O4]3 Tb2[C4H4O6]3 Tb2O3 TbCl+2
Common/IUPAC Name Strontium sulfite Strontium sulfate Strontium tungstate(VI) Tantalum Tantalum(V) oxide Tantalum(V) bromide Tantalum(V) chloride Tantalum(V) fluoride Tantalate ion(-1) Terbium Terbium(III) nitrate Terbium(III) hydroxide NTA ion(-1) Terbium(III) dihydroxide ion(+1) Terbium(III) hydroxide Terbium(III) tetrahydroxide ion(-1) Terbium(III) disulfate ion(-1) Terbium(III) EDTA ion(-1) Terbium(III) DTPA ion(-2) Terbium(III) monoacetate ion(+2) Terbium(III) diacetate ion(+1) Terbium(III) acetate Terbium(III) monooxalate ion(+1) Terbium(III) dioxalate ion(-1) Terbium(III) monotartrate ion(+1) Terbium(III) citrate Terbium(III) NTA Terbium di-NTA ion(-3) Terbium(III) dihydrogen DTPA Terbium(III) hydrogen EDTA Terbium(III) monofluoride ion(+2) Terbium ion(+3) Terbium(III) carbonate Terbium(III) sulfate Terbium(III) sulfate octahydrate Terbium(III) oxalate Terbium(III) tartrate Terbium(III) oxide Terbium(III) monochloride ion(+2)
Aspen HYSYSOLI Interface Name SRSO3 SRSO4 SRWO4 TAEL TA2O5 TABR5 TACL5 TAF5 TAO3ION TBEL TBNO33 TBOHNTAION TBOH2ION TBOH3 TBOH4ION TBSO42ION TBEDTAION TBDTPAION TBACETION TBACET2ION TBACET3 TBC2O4ION TBC2O42ION TBTRTRTION TBCTRT TBNTA TBNTA2ION TBH2DTPA TBHEDTA TBFION TBION TB2CO33 TB2SO43 TB2SO43.8H2O TB2C2O43 TB2TRTRT3 TB2O3 TBCLION
A-122
Formula TbCl2+1 TbCl3 TbCl3.6H2O TbCl4-1 TbCO3+1 TbF2+1 TbF3 TbF4-1 TbH2PO4+2 TbHC14H18N3O10-1 TbHCO3+2 TbI+2 TbI3 TbNO3+2 TbOH+2 TbPO4 TbSO4+1 Tc Tc(OH)2CO3 Tc(OH)3CO3-1 Tc2O7 TcO(OH)+1 TcO(OH)2 TcO(OH)3-1 TcO+2 TcO2 TcO2.2H2O TcO4-1 Te Te(OH)3+1 Te-2 TeO2 Th Th(C2O4)2 Th(C2O4)3-2 Th(C2O4)4-4
Common/IUPAC Name Terbium(III) dichloride ion(+1) Terbium(III) chloride Terbium(III) chloride hexahydrate Terbium(III) tetrachloride ion(-1) Terbium(III) carbonate ion(+1) Terbium difluoride ion(+1) Terbium(III) fluoride Terbium(III) tetrafluoride ion(-1) Terbium dihydrogen orthophosphate ion(+2) Terbium(III) hydrogen DTPA ion(-1) Terbium(III) bicarbonate ion(+2) Terbium(III) monoiodide ion(+2) Terbium(III) iodide Terbium(III) mononitrate ion(+2) Terbium(III) monohydroxide ion(+2) Terbium(III) orthophosphate Terbium(III) monosulfate ion(+1) Technetium Technetium(IV) dihydroxide carbonate Technetium(IV) trihydroxide carbonate ion(-1) Technetium heptoxide Oxytechnetium(IV) monohydroxide ion(+1) Oxytechnetium(IV) dihydroxide Oxytechnetium(IV) trihydroxide ion(-1) Oxytechmetium(IV) ion(+2) Technetium(IV) dioxide Technetium(IV) dioxide dihydrate Pertechnetate(VII) ion Tellurium Tellurium(IV) trihydroxide ion(+1) Telluride ion(-2) Tellurium(IV) oxide Thorium Thorium(IV) oxalate Thorium(IV) trioxalate ion(-2) Thorium(IV) tetraoxalate ion(-4)
Aspen HYSYSOLI Interface Name TBCL2ION TBCL3 TBCL3.6H2O TBCL4ION TBCO3ION TBF2ION TBF3 TBF4ION TBH2PO4ION TBHDTPAION TBHCO3ION TBIION TBI3 TBNO3ION TBOHION TBPO4 TBSO4ION TCEL TCIVOH2CO3 TCIVOH3CO3ION TCVII2O7 TCIVOOHION TCIVOOH2 TCIVOOH3ION TCIVOION TCIVO2 TCIVO2.2H2O TCVIIO4ION TEEL TEIVOH3ION TEION TEO2 THEL THC2O42 THC2O43ION THC2O44ION
A-123
A-124
Formula Th(H2PO4)2+2 Th(HPO4)2 Th(HPO4)3-2 Th(NO3)2+2 Th(NO3)3+1 Th(NO3)4 Th(NO3)4.4H2O Th(NO3)4.5H2O Th(NO3)4.6H2O Th(OH)2+2 Th(OH)3+1 Th(OH)4 Th(SO4)2 Th(SO4)3-2 Th(SO4)4-4 Th[C10H12N2O8] Th[C14H18N3O10]-1 Th[C6H6NO6]+1 Th[HC10H12N2O8]+1 Th[HC14H18N3O10] Th[HC6H6NO6] Th+4 Th2(OH)2+6 ThBr4 ThBr4.10H2O ThBr4.12H2O ThBr4.7H2O ThC2O4+2 ThCl+2 ThCl+3 ThCl3+1 ThCl4 ThCl4.2H2O ThCl4.7H2O ThCl4.8H2O ThCl4.8H2O ThF+3
Common/IUPAC Name Thorium(IV) di(dihydrogen orthophosphate) ion(+2) Thorium(IV) hydrogen orthophosphate Thorium(IV) tri(hydrogen orthophosphate) ion(-2) Thorium(IV) dinitrate ion(+2) Thorium(IV) trinitrate ion(+1) Thorium(IV) nitrate Thorium(IV) nitrate tetrahydrate Thorium(IV) nitrate pentahydrate Thorium(IV) nitrate hexahydrate Thorium(IV) dihydroxide ion(+2) Thorium(IV) trihydroxide ion(+1) Thorium(IV) hydroxide Thorium(IV) sulfate Thorium(IV) trisulfate ion(-2) Thorium(IV) tetrasulfate ion(-4) Thorium(IV) EDTA Thorium(IV) DTPA ion(-1) Thorium(IV) NTA ion(+1) Thorium(IV) hydrogen EDTA ion(+1) Thorium(IV) hydrogen DTPA Thorium(IV) hydroxide NTA Thorium ion(+4) Dithorium(IV) dihydroxide ion(+6) Thorium(IV) bromide Thorium(IV) bromide decahydrate Thorium(IV) bromide dodecahydarate Thorium(IV) bromide heptahydrate Thorium(IV) monooxalate ion(+2) Thorium(IV) dichloride ion(+2) Thorium(IV) monochloride ion(+3) Thorium(IV) trichloride ion(+1) Thorium(IV) chloride Thorium(IV) chloride dihydrate Thorium(IV) chloride heptahydrate Thorium(IV) chloride tetrahydrate Thorium(IV) chloride octahydrate Thorium(IV) monofluoride ion(+3)
Aspen HYSYSOLI Interface Name THH2PO42ION THHPO42 THHPO43ION THNO32ION THNO33ION THNO34 THNO34.4H2O THNO34.5H2O THNO34.6H2O THOH2ION THOH3ION THOH4 THSO42 THSO43ION THSO44ION THEDTA THDTPAION THNTAION THHEDTAION THHDTPA THOHNTA THION TH2OH2ION THBR4 THBR4.10H2O THBR4.12H2O THBR4.7H2O THC2O4ION THCL2ION THCLION THCL3ION THCL4 THCL4.2H2O THCL4.7H2O THCL4.4H2O THCL4.8H2O THFION
A-124
Formula ThF2+2 ThF3+1 ThF4 ThF4.2.5H2O ThH2PO4+3 ThHC2O4+3 ThHPO4+2 ThI4 ThNO3+3 ThO2 ThOH+3 ThS2 ThSO4+2 Ti Ti(CO3)2 Ti(HCO3)2+1 Ti(HCO3)3 Ti(HCO3)4 Ti(OH)2+1 Ti(OH)2+2 Ti(OH)3 Ti(OH)3+1 Ti(OH)4 Ti(SO4)2 Ti[C10H12N2O8]-1 Ti[HC10H12N2O8] Ti+3 Ti+4 Ti2(CO3)3 Ti2(SO4)3 Ti2O3 TiCl+1 TiCl+2 TiCl+3 TiCl2+1 TiCl2+2 TiCl3
Common/IUPAC Name Thorium(IV) difluoride ion(+2) Thorium(IV) trifluoride ion(+1) Thorium(IV) fluoride Thorium(IV) fluoride 2.5 hydrate Thorium(IV) dihydrogen orthophosphate ion(+3) Thorium(IV) bicarbonate ion(+3) Thorium(IV) hydrogen orthophosphate ion(+2) Thorium(IV) iodide Thorium(IV) mononitrate ion(+3) Thorium dioxide Thorium(IV) monohydroxide ion(+3) Thorium(IV) sulfide Thorium(IV) monosulfate ion(+2) Titanium Titanium(IV) carbonate Titanium(III) dibicarbonate ion(+1) Titanium(III) bicarbonate Titanium(IV) bicarbonate Titanium(III) dihydroxide ion(+1) Titanium(IV) dihydroxide ion(+2) Titanium(III) hydroxide Titanium(IV) trihydroxide ion(+1) Titanium(IV) hydroxide Titanium(IV) sulfate Thorium(IV) EDTA ion(-1) Titanium(III) hydrogen EDTA Titanium ion(+3) Titanium ion(+4) Titanium(III) carbonate Titanium(III) sulfate Titanium(III) oxide Titanium(IV) trichloride ion(+1) Titanium(III) monochloride ion(+2) Titanium(IV) monochloride ion(+3) Titanium(III) dichloride ion(+1) Titanium(IV) dichloride ion(+2) Titanium(III) chloride
Aspen HYSYSOLI Interface Name THF2ION THF3ION THF4 THF4.2.5H2O THH2PO4ION THHC2O4ION THHPO4ION THI4 THNO3ION THO2 THOHION THS2 THSO4ION TIEL TIIVCO32 TIHCO32ION TIHCO33 TIIVHCO34 TIIIIOH2ION TIIVOH2ION TIIIIOH3 TIIVOH3ION TIIVOH4 TIIVSO42 TIEDTAION TIHEDTA TIIIIION TIIVION TIIII2CO33 TIIII2SO43 TI2O3 TIIVCL3ION TIIIICLION TIIVCLION TIIIICL2ION TIIVCL2ION TIIIICL3
A-125
A-126
Formula TiCl4 TiCl4-1 TiCO3+1 TiCO3+2 TiF+2 TiF+3 TiF2+1 TiF2+2 TiF3 TiF3+1 TiF4 TiF4-1 TiHCO3+2 TiHCO3+3 TiO2 TiOH+2 TiOH+3 TiOSO4 TiOSO4.2H2O TiSO4+1 TiSO4+2 Tl Tl(OH)3 Tl+1 Tl+3 TlOH Tm Tm(NO3)3 Tm(OH)[C6H6NO6]-1 Tm(OH)2+1 Tm(OH)3 Tm(OH)4-1 Tm(SO4)2-1 Tm[C10H12N2O8]-1 Tm[C14H18N3O10]-2 Tm[C2H3O2]+1 Tm[C2H3O2]+2 Tm[C2H3O2]3
Common/IUPAC Name Titanium(IV) chloride Titanium(III) tetrachloride ion(-1) Titanium(III) carbonate ion(+1) Titanium(IV) carbonate ion(+2) Titanium(III) monofluoride ion(+2) Titanium(IV) monofluoride ion(+3) Titanium(III) difluoride ion(+1) Titanium(IV) difluoride ion(+2) Titanium(III) fluoride Titanium(IV) trifluoride ion(+1) Titanium(IV) fluoride Titanium(III) tetrafluoride ion(-1) Titanium(III) monobicarbonate ion(+2) Titanium(IV) bicarbonate ion(+3) Titanium(IV) oxide Titanium(III) monohydroxide ion(+2) Titanium(IV) monohydroxide ion(+3) Titanyl(IV) sulfate Titanyl(IV) sulfate dihydrate Titanium(III) sulfate ion(+1) Titanium(IV) sulfate ion(+2) Thallium Thallium(III) hydroxide Thallium ion(+1) Thallium ion(+3) Thallium(I) hydroxide Thulium Thulium(III) nitrate Thulium(III) hydroxide NTA ion(-1) Thulium(III) dihydroxide ion(+1) Thulium(III) hydroxide Thulium(III) tetrahydroxide ion(-1) Thulium(III) disulfate ion(-1) Thulium(III) EDTA ion(-1) Thulium(III) DTPA ion(-2) Thulium(III) diacetate ion(+1) Thulium(III) monoacetate ion(+2) Thulium(III) acetate
Aspen HYSYSOLI Interface Name TIIVCL4 TIIIICL4ION TIIIICO3ION TIIVCO3ION TIIIIFION TIIVFION TIIIIF2ION TIIVF2ION TIIIIF3 TIIVF3ION TIIVF4 TIIIIF4ION TIHCO3ION TIIVHCO3ION ANATASE TIIIIOHION TIIVOHION TIOST TIOST.2H2O TIIIISO4ION TIIVSO4ION TLEL TLIIIOH3 TLION TLIIIION TLOH TMEL TMNO33 TMOHNTAION TMOH2ION TMOH3 TMOH4ION TMSO42ION TMEDTAION TMDTPAION TMACET2ION TMACETION TMACET3
A-126
Formula Tm[C2O4]+1 Tm[C2O4]2-1 Tm[C4H4O6]+1 Tm[C6H5O7] Tm[C6H6NO6] Tm[C6H6NO6]2-3 Tm[H2C14H18N3O10] Tm[HC10H12N2O8] Tm[HC14H18N3O10]-1 Tm+3 Tm2(CO3)3 Tm2(SO4)3 Tm2[C2O4]3 Tm2[C4H4O6]3 Tm2O3 TmCl+2 TmCl2+1 TmCl3 TmCl4-1 TmCO3+1 TmF+2 TmF2+1 TmF3 TmF4-1 TmH2PO4+2 TmHCO3+2 TmNO3+2 TmOH+2 TmPO4 TmSO4+1 U U(CO3)2 U(HPO4)2 U(HPO4)2.4H2O U(OH)2+2 U(OH)3 U(OH)3+1
Common/IUPAC Name Thulium(III) monooxalate ion(+1) Thulium(III) dioxalate ion(-1) Thulium(III) tartrate ion(+1) Thulium(III) citrate Thulium(III) NTA Thulium(III) di-NTA ion(-3) Thulium(III) dihydrogen DTPA Thulium(III) hydrogen EDTA Thulium(III) hydrogen DTPA ion(-1) Thulium ion(+3) Thulium(III) carbonate Thulium(III) sulfate Thulium(III) oxalate Thulium(III) tartrate Thulium(III) oxide Thulium(III) monochloride ion(+2) Thulium(III) dichloride ion(+1) Thulium(III) chloride Thulium(III) tetrachloride ion(-1) Thulium(III) carbonate ion(+1) Thulium(III) monofluoride ion(+2) Thulium difluoride ion(+1) Thulium(III) fluoride Thulium(III) tetrafluoride ion(-1) Thulium(III) dihydrogen orthophosphate ion(+2) Thulium bicarbonate ion(+2) Thulium(III) nitrate ion(+2) Thulium(III) hydroxide ion(+2) Thulium(III) orthophosphate Thulium(III) monosulfate ion(-1) Uranium Uranium(IV) carbonate Uranium(IV) hydrogen orthophosphate Uranium(IV) hydrogen orthophosphate tetrahydrate Uranium(IV) dihydroxide ion(+2) Uranium(III) hydroxide Uranium(IV) trihydroxide ion(+1)
Aspen HYSYSOLI Interface Name TMC2O4ION TMC2O42ION TMTRTRTION TMCTRT TMNTA TMNTA2ION TMH2DTPA TMHEDTA TMHDTPAION TMION TM2CO33 TM2SO43 TM2C2O43 TM2TRTRT3 TM2O3 TMCLION TMCL2ION TMCL3 TMCL4ION TMCO3ION TMFION TMF2ION TMF3 TMF4ION TMH2PO4ION TMHCO3ION TMNO3ION TMOHION TMPO4 TMSO4ION UEL UIVCO32 UIVHPO42 UIVHPO42.4H2O UIVOH2ION UIIIOH3 UIVOH3ION
A-127
A-128
Formula U(OH)4 U(OH)5-1 U(SO3)2 U(SO4)2 U[C10H12N2O8] U[C2H3O2]+2 U[C2H3O2]2+1 U[C2H3O2]3 U[HCOO]+2 U[HCOO]2+1 U[HCOO]3 U+3 U+4 U3(PO4)4 UBr2Cl UBr2Cl2 UBr2I2 UBr3 UBr3Cl UBr3I UBr4 UBr5 UBrCl2 UBrCl3 UBrI3 UCl+3 UCl2F2 UCl2I2 UCl3 UCl3F UCl3I UCl4 UCl5 UCl6 UClF3 UClI3 UF+3 UF2+2
Common/IUPAC Name Uranium(IV) hydroxide Uranium(IV) pentahydroxide ion(-1) Uranium(IV) sulfite Uranium(IV) sulfate Uranium(IV) EDTA Uranium(III) monoacetate ion(+1) Uranium(III) diacetate ion(+1) Uranium(III) acetate Uranium(III) monoformate ion(+2) Uranium(III) diformate ion(+1) Uranium(III) formate Uranium ion(+3) Uranium ion(+4) Uranium(IV) orthophosphate Uranium(III) dibromide chloride Uranium(IV) dibromide dichloride Uranium(IV) dibromide diiodide Uranium(III) bromide Uranium(IV) tribromide chloride Uranium(IV) tribromide iodide Uranium(IV) bromide Uranium(V) bromide Uranium(III) bromide dichloride Uranium(IV) bromide trichloride Uranium(IV) bromide triiodide Uranium(IV) monochloride ion(+3) Uranium(IV) dichloride difluoride Uranium(IV) dichloride diiodide Uranium(III) chloride Uranium(IV) trichloride fluoride Uranium(IV) trichloride iodide Uranium(IV) chloride Uranium(V) chloride Uranium(VI) chloride Uranium(IV) chloride trifluoride Uranium(IV) chloride triiodide Uranium(IV) monofluoride ion(+3) Uranium(IV) difluoride ion(+2)
Aspen HYSYSOLI Interface Name UIVOH4 UIVOH5ION UIVSO32 UIVSO42 UIVEDTA UIIIACION UIIIAC2ION UIIIAC3 UCOOHION UCOOH2ION UCOOH3 UIIIION UIVION UIV3PO44 UBR2CL UBR2CL2 UBR2I2 UIIIBR3 UBR3CL UBR3I UIVBR4 UVBR5 UBRCL2 UBRCL3 UBRI3 UIVCLION UCL2F2 UCL2I2 UIIICL3 UCL3F UCL3I UIVCL4 UVCL5 UCL6 UCLF3 UCLI3 UIVFION UIVF2ION
A-128
Formula UF3 UF3+1 UF4 UF4.2.5H2O UF5 UF6 UI3 UI4 UO2 UO2(C2O4)2-2 UO2(C2O4)3-4 UO2(CO3)2-2 UO2(CO3)3-4 UO2(IO3)2 UO2(NO3)2 UO2(NO3)2.2H2O UO2(NO3)2.3H2O UO2(NO3)2.6H2O UO2(OH)2 UO2(SO4)2-2 UO2[C2H3O2]+1 UO2[C2H3O2]2 UO2[C2H3O2]3-1 UO2[C6H5O7]-1 UO2[C6H6NO6]-1 UO2[HC10H12N2O8]-1 UO2[HC6H5O7] UO2[HC6H6NO6] UO2+1 UO2+2 UO2Br2 UO2Br2.1H2O UO2Br2.3H2O UO2C2O4 UO2C2O4.3H2O UO2Cl+1 UO2Cl2 UO2Cl2.3H2O
Common/IUPAC Name Uranium(III) fluoride Uranium(IV) trifluoride ion(+1) Uranium(IV) fluoride Uranium(IV) fluoride 2.5 hydrate Uranium(V) fluoride Uranium(VI) fluoride Uranium(III) iodide Uranium(IV) iodide Uranium(IV) oxide Uranyl(VI) dioxalate ion(-2) Uranyl(VI) trioxalate ion(-4) Uranyl(VI) dicarbonate ion(-2) Uranyl(VI) tricarbonate ion(-4) Uranyl(VI) iodate Uranyl(VI) nitrate Uranyl(VI) nitrate dihydrate Uranyl(VI) nitrate trihydrate Uranyl(VI) nitrate hexahydrate Uranyl(VI) hydroxide Uranyl(VI) disulfate ion(-2) Uranyl(VI) monoacetate ion(+1) Uranyl(VI) acetate Uranyl(VI) triacetate ion(-1) Uranyl(VI) monocitrate ion(-1) Uranyl(VI) NTA ion(-1) Uranyl(VI) hydrogen EDTA ion(-1) Uranyl(VI) hydrogen citrate Uranyl(VI) hydrogen NTA Uranyl(V) ion(+1) Uranyl(VI) ion(+2) Uranyl(VI) bromide Uranyl(VI) bromide monohydrate Uranyl(VI) bromide trihydrate Uranyl(VI) oxalate Uranyl(VI) oxalate trihydrate Uranyl(VI) monochloride ion(+1) Uranyl(VI) chloride Uranyl(VI) chloride trihydrate
Aspen HYSYSOLI Interface Name UIIIF3 UIVF3ION UIVF4 UIVF4.2.5H2O UVF5 UVIF6 UIOD3 UIVI4 UIVO2 UO2C2O42ION UO2C2O43ION UO2CO32ION UO2CO33ION UO2IO32 UO2NO32 UO2NO32.2H2O UO2NO32.3H2O UO2NO32.6H2O UO2OH2 UO2SO42ION UO2ACION UO2AC2 UO2AC3ION UO2CTRTION UO2NTAION UO2HEDTAION UO2HCTR UO2HNTA UVO2ION UO2ION UO2BR2 UO2BR2.1H2O UO2BR2.3H2O UO2C2O4 UO2C2O4.3H2O UO2CLION UO2CL2 UO2CL2.3H2O
A-129
A-130
Formula UO2Cl2.H2O UO2CO3 UO2F+1 UO2F2 UO2F2.3H2O UO2F3-1 UO2F4-2 UO2IO3+1 UO2OH UO2OH+1 UO2SO3 UO2SO4 UO2SO4.3H2O UOH+3 USO4+2 V V(C2O4)2-1 V(OH)3 V+2 V+3 V2(C2O4)3 V2O3 V2O4 V2O5 VBr3 VC2O4+1 VCl3 VF3 VO(C2O4)2-2 VO(OH)+1 VO(OH)2 VO(OH)3 VO+2 VO2+1 VO2Cl VO2F VO2F2-1 VO2F3-2
Common/IUPAC Name Uranyl(VI) chloride monohydrate Uranyl(VI) carbonate Uranyl(VI) monofluoride ion(+1) Uranyl(VI) fluoride Uranyl(VI) fluoride trihydrate Uranyl(VI) trifluoride ion(-1) Uranyl(VI) tetrafluoride ion(-2) Uranyl(VI) monoiodate ion(+1) Uranyl(V) hydroxide Uranyl(VI) monohydroxide ion(+1) Uranyl(VI) sulfite Uranyl(VI) sulfate Uranyl(VI) sulfate trihydrate Uranium(IV) monohydroxide ion(+3) Uranium(IV) sulfate ion(+2) Vanadium Vanadium(III) dioxalate ion(-1) Vanadium(III) hydroxide Vanadium ion(+2) Vanadium ion(+3) Vanadium(III) oxalate Vanadium(III) oxide Vanadium(IV) oxide Vanadium(V) pentoxide Vanadium(III) bromide Vanadium(III) monooxalate ion(+1) Vanadium(III) chloride Vanadium(III) fluoride Vanadyl(IV) dioxalate ion(-2) Vanadyl(IV) monohydroxide ion(+1) Vanadyl(IV) hydroxide Vanadate(V) hydroxide Vanadyl ion(+2) Vanadite ion(+1) Vanadite(V) chloride Vanadite(V) fluoride Vanadite(V) difluoride ion(-1) Vanadite(V) trifluoride ion(-2)
Aspen HYSYSOLI Interface Name UO2CL2.H2O UO2CO3 UO2FION UO2F2 UO2F2.3H2O UO2F3ION UO2F4ION UO2IO3ION UVO2OH UO2OHION UO2SO3 UO2SO4 UO2SO4.3H2O UIVOHION UIVSO4ION VEL VC2O42ION VIIIOH3 VIIION VIIIION V2C2O43 V2O3 V2O4 V2O5 VBR3 VC2O4ION VCL3 VF3 VOC2O42ION VOOHION VOOH2 VOOH3 VOION VO2ION VO2CL VO2F VO2F2ION VO2F3ION
A-130
Formula VO2OH VOC2O4 VOCl+1 VOCl2 VOF+1 VOF2 VOF3-1 VOF4-2 VOH+2 VOSO4 VOSO4.6H2O W WO4-2 Xe Y Y(C2O4)2-1 Y(C2O4)3-3 Y(NO3)2+1 Y(NO3)3 Y(OH)[C6H6NO6]-1 Y(OH)2+1 Y(OH)3 Y(OH)4-1 Y(SO4)2-1 Y[C10H12N2O8]-1 Y[C14H18N3O10]-2 Y[C2H3O2]+2 Y[C2H3O2]2+1 Y[C2H3O2]3 Y[C4H4O6]+1 Y[C6H6NO6] Y[C6H6NO6]-3 Y[H2C14H18N3O10] Y[HC10H12N2O8] Y[HC14H18N3O10]-1 Y+3 Y2(C2O4)3 Y2(SO4)3
Common/IUPAC Name Vanadite(V) hydroxide Vanadyl(IV) oxalate Vanadyl monochloride ion(+1) Vanadyl(IV) chloride Vanadyl(IV) monofluoride ion(+1) Vanadyl(IV) fluoride Vanadyl(IV) trifluoride ion(-1) Vanadyl(IV) tetrafluoride ion(-2) Vanadium(III) monohydroxide ion(+2) Vanadyl(IV) sulfate Vanadyl(IV) sulfate hexahydrate Tungsten Tungsten(VI) tetraoxide ion(-2) Xenon Yttrium Yttrium(III) dioxalate ion(-1) Yttrium(III) trioxalate ion(-3) Yttrium dinitrate ion(+1) Yttrium nitrate Yttrium hydroxide NTA ion(-1) Yttrium dihydroxide ion(+1) Yttrium hydroxide Yttrium tetrahydroxide ion(-1) Yttrium disulfate ion(-1) Yttrium(III) EDTA ion(-1) Yttrium(III) DTPA ion(-2) Yttrium monoacetate ion(+2) Yttrium diacetate ion(+1) Yttrium acetate Yttrium tartrate ion(+1) Yttrium NTA Yttrium di-NTA ion(-3) Yttrium dihydrogen DTPA Yttrium hydrogen EDTA Yttrium hydrogen DTPA ion(-1) Yttrium ion(+3) Yttrium oxalate Yttrium sulfate
Aspen HYSYSOLI Interface Name VO2OH VOC2O4 VOCLION VOCL2 VOFION VOF2 VOF3ION VOF4ION VIIIOHION VOSO4 VOSO4.6H2O WEL WO4ION XE EYEL EYC2O42ION EYC2O43ION EYNO32ION EYNO33 EYOHNTAION EYOH2ION EYOH3 EYOH4ION EYSO42ION EYEDTAION EYDTPAION EYACETION EYACET2ION EYACET3 EYTARTRTION EYNTA EYNTA2ION EYH2DTPA EYHEDTA EYHDTPAION EYION EY2C2O43 EY2SO43
A-131
A-132
Formula Y2(SO4)3.8H2O Y2(WO4)3 Y2[C4H4O6]3 Y2O3 Yb Yb(NO3)3 Yb(OH)[C6H6NO6]-1 Yb(OH)2 Yb(OH)2+1 Yb(OH)3 Yb(OH)4-1 Yb(SO4)2-1 Yb[C10H12N2O8]-1 Yb[C14H18N3O10]-2 Yb[C2H3O2]+2 Yb[C2H3O2]2+1 Yb[C2H3O2]3 Yb[C4H4O6]+1 Yb[C6H5O7] Yb[C6H6NO6] Yb[C6H6NO6]2-3 Yb[CHO2]+2 Yb[CHO2]2+1 Yb[CHO2]3 Yb[H2C14H18N3O10] Yb[HC10H12N2O8] Yb[HC14H18N3O10]-1 Yb+2 Yb+3 Yb2(CO3)3 Yb2(SO4)3 Yb2(SO4)3.8H2O Yb2[C4H4O6]3 YbCl+2 YbCl2+1 YbCl3 YbCL3.6H2O YbCl4-1
Common/IUPAC Name Yttrium sulfate octahydrate Yttrium tungstate(VI) Yttrium tartrate Yttrium oxide Ytterbium Ytterbium(III) nitrate Ytterbium(III) hydroxide NTA ion(-1) Ytterbium(II) hydroxide Ytterbium(III) dihydroxide ion(+1) Ytterbium(III) hydroxide Ytterbium(III) tetrahydroxide ion(-1) Ytterbium(III) disulfate ion(-1) Ytterbium(III) EDTA ion(-1) Ytterbium(III) DTPA ion(-2) Ytterbium(III) monoacetate ion(+2) Ytterbium(III) diacetate ion(+1) Ytterbium(III) acetate Ytterbium(III) monotartrate ion(+1) Ytterbium(III) citrate Ytterbium(III) NTA Ytterbium(III) di-NTA ion(-3) Ytterbium(III) monoformate ion(+2) Ytterbium(III) diformate ion(+1) Ytterbium(III) formate Ytterbium(III) dihydrogen DTPA Ytterbium(III) hydrogen EDTA Ytterbium(III) hydrogen DTPA ion(-1) Ytterbium ion(+2) Ytterbium ion(+3) Ytterbium(III) carbonate Ytterbium(III) sulfate Ytterbium(III) sulfate octahydrate Ytterbium(III) tartrate Ytterbium(III) monochloride ion(+2) Ytterbium(III) dichloride ion(+1) Ytterbium(III) chloride Ytterbium(III) chloride hexahydrate Ytterbium(III) tetrachloride ion(-1)
Aspen HYSYSOLI Interface Name EY2SO43.8H2O EY2WO43 EY2TARTRT3 EY2O3 EYBEL EYBNO33 EYBOHNTAION EYBIIOH2 EYBOH2ION EYBOH3 EYBOH4ION EYBSO42ION EYBEDTAION EYBDTPAION EYBACETION EYBACET2ION EYBACET3 EYBTRTRTION EYBCTRT EYBNTA EYBNTA2ION EYBFORION EYBFOR2ION EYBFOR3 EYBH2DTPA EYBHEDTA EYBHDTPAION EYBIIION EYBIIIION EYB2CO33 EYB2SO43 EYB2SO43.8H2O EYB2TRTRT3 EYBCLION EYBCL2ION EYBCL3 EYBCL3.6H2O EYBCL4ION
A-132
Formula YbCO3+1 YbF+2 YbF2+1 YbF3 YbF4-1 YbH2PO4+2 YbHCO3+2 YbNO3+2 YbOH+2 YbPO4 YBr+2 YBr3 YbSO4+1 YC2O4+1 YCl+2 YCl3 YCl3.6H2O YF+2 YF2+1 YF3 YH2PO4+2 YNO3+2 YOH+2 YPO4 YPO4.2H2O YSO4+1 Zn Zn(C2O4)2-2 Zn(C2O4)3-4 Zn(CN)2 Zn(CN)3-1 Zn(CN)4-2 Zn(HC2O4)2 Zn(HCO3)2 Zn(HS)2 Zn(HSO3)2 Zn(HSO4)2
Common/IUPAC Name Ytterbium(III) carbonate ion(+1) Ytterbium(III) monofluoride ion(+2) Ytterbium(III) difluoride ion(+1) Ytterbium(III) fluoride Ytterbium(III) tetrafluoride ion(-1) Ytterbium(III) dihydrogen orthophosphate ion(+2) Ytterbium(III) bicarbonate ion(+2) Ytterbium(III) mononitrate ion(+2) Ytterbium(III) monohydroxide ion(+2) Ytterbium(III) orthophosphate Yttrium(III) monobromide ion(+2) Yttrium(III) bromide Ytterbium(III) monosulfate ion(+1) Yttrium(III) monooxalate ion(+1) Yttrium(III) monochloride ion(+2) Yttrium(III) chloride Yttrium(III) chloride hexahydrate Yttrium monofluoride ion(+2) Yttrium difluoride ion(+1) Yttrium fluoride Yttrium dihydrogen orthophosphate ion(+2) Yttrium mononitrate ion(+2) Yttrium monohydroxide ion(+2) Yttrium orthophosphate Yttrium orthophosphate dihydrate Yttrium monosulfate ion(+1) Zinc Zinc dioxalate ion(-2) Zinc trioxalate ion(-4) Zinc cyanide Zinc tricyanide ion(-1) Zinc tetracyanide ion(-2) Zinc hydrogen oxalate Zinc bicarbonate Zinc bisulfide Zinc bisulfite Zinc bisulfate
Aspen HYSYSOLI Interface Name EYBCO3ION EYBFION EYBF2ION EYBF3 EYBF4ION EYBH2PO4ION EYBHCO3ION EYBNO3ION EYBOHION EYBPO4 EYBRION EYBR3 EYBSO4ION EYC2O4ION EYCLION EYCL3 EYCL3.6H2O EYFION EYF2ION EYF3 EYH2PO4ION EYNO3ION EYOHION EYPO4 EYPO4.2H2O EYSO4ION ZNEL ZNC2O42ION ZNC2O43ION ZNCN2 ZNCN3ION ZNCN4ION ZNHC2O42 ZNHCO32 ZNHS2 ZNHSO32 ZNHSO42
A-133
A-134
Formula Zn(NH2CO2)2 Zn(NH3)2+2 Zn(NH3)3+2 Zn(NH3)4+2 Zn(NO3)2 Zn(NO3)2.1H2O Zn(NO3)2.2H2O Zn(NO3)2.4H2O Zn(NO3)2.6H2O Zn(OH)[C10H12N2O8]3 Zn(OH)[C6H6NO6]-2 Zn(OH)2 Zn(OH)3-1 Zn(OH)4-2 Zn(SCN)2 Zn(SCN)3-1 Zn(SCN)4-2 Zn[C10H12N2O8]-2 Zn[C14H18N3O10]-3 Zn[C2H14NO]2+2 Zn[C2H3O2]+1 Zn[C2H3O2]2 Zn[C2H3O2]3-1 Zn[C2H3O3]+1 Zn[C2H3O3]2 Zn[C2H4NO2]2 Zn[C2H7NO]+2 Zn[C2H7NO]3+2 Zn[C2H8N2]+2 Zn[C2H8N2]2+2 Zn[C2H8N2]3+2 Zn[C3H6NO2]+1 Zn[C3H6NO2]2 Zn[C4H4O6] Zn[C5H13NO2]2+2 Zn[C5H13NO2]3+2 Zn[C5H13NO2]4+2
Common/IUPAC Name Zinc carbamate Zinc diammonia ion(+2) Zinc triammonia ion(+2) Zinc tetraammonia ion(+2) Zinc nitrate Zinc nitrate monohydrate Zinc nitrate dihydrate Zinc nitrate tetrahydrate Zinc nitrate hexahydrate Zinc hydroxide EDTA ion(-3) Zinc hydroxide NTA ion(-2) Zinc hydroxide, amorphous Zinc trihydroxide ion(-1) Zinc tetrahydroxide ion(-2) Zinc dithiocyanate Zinc trithiocyanate ion(-1) Zinc tetrathiocyanate ion(-4) Zinc EDTA ion(-2) Zinc DTPA ion(-3) Zinc di(2-aminoethanol) ion(+2) Zinc monoacetate ion(+1) Zinc acetate Zinc triacetate ion(-1) Zinc monoglycolate ion(+1) Zinc glycolate Zinc diglycine Zinc mono(2-aminoethanol) ion(+2) Zinc tri(2-aminoethanol) ion(+2) Zinc mono(ethylenediamine) ion(+2) Zinc di(ethylenediamine) ion(+2) Zinc tri(ethylenediamine) ion(+2) Zinc monoalanate ion(+1) Zinc dialanate Zinc tartrate Zinc di(diethanolmethylamine) ion(+2) Zinc tri(diethanolmethylamine) ion(+2) Zinc tetra(diethanolmethylamine) ion(+2)
Aspen HYSYSOLI Interface Name ZNNH2CO22 ZNNH32ION ZNNH33ION ZNNH34ION ZNNO32 ZNNO32.1H2O ZNNO32.2H2O ZNNO32.4H2O ZNNO32.6H2O ZNOHEDTAION ZNOHNTAION ZNOH2 ZNOH3ION ZNOH4ION ZNSCN2 ZNSCN3ION ZNSCN4ION ZNEDTAION ZNDTPAION ZNMEXH2ION ZNACETION ZNACET2 ZNACET3ION ZNGLYCOLION ZNGLYCOL2 ZNGLYCIN2 ZNMEXHION ZNMEXH3ION ZNEDAION ZNEDA2ION ZNEDA3ION ZNALANION ZNALAN2 ZNTRTRT ZNMDEXH2ION ZNMDEXH3ION ZNMDEXH4ION
A-134
Formula Zn[C5H15NO2]+2 Zn[C6H5O7]-1 Zn[C6H6NO6]-1 Zn[C6H6NO6]2-4 Zn[H2C10H12N2O8] Zn[H2C14H18N3O10]1 Zn[H2C6H5O7]+1 Zn[H3C14H18N3O10] Zn[HC10H12N2O8]-1 Zn[HC14H18N3O10]-2 Zn[HC6H5O7] Zn[HC6H6NO6] Zn[HCOO]+1 Zn[HCOO]2 Zn[HCOO]2.2H2O Zn+2 Zn2[C14H18N3O10]-1 Zn3(PO4)2 Zn3(PO4)2.1H2O Zn3(PO4)2.2H2O Zn3(PO4)2.4H2O ZnBr+1 ZnBr2 ZnBr2.2H2O ZnBr3-1 ZnC2H4NO2+1 ZnC2O4 ZnC2O4.2H2O ZnCl+1 ZnCl2 ZnCl2.1H2O ZnCl2.3H2O ZnCl2.5ZnO ZnCl2.5ZnO.8H2O ZnCl3-1 ZnCN+1 ZnCO3
Common/IUPAC Name Zinc mono(diethanolmethylamine) ion(+2) Zinc citrate ion(-1) Zinc NTA ion(-1) Zinc di-NTA ion(-4) Zinc dihydrogen EDTA Zinc dihydrogen DTPA ion(-1) Zinc dihydrogen citrate ion(+1) Zinc trihydrogen DTPA Zinc hydrogen EDTA ion(-1) Zinc hydrogen DTPA ion(-2) Zinc hydrogen citrate Zinc hydrogen NTA Zinc monoformate ion(+1) Zinc formate Zinc formate dihydrate Zinc ion(+2) Dizinc DTPA ion(-1) Zinc orthophosphate Zinc orthophosphate monohydrate Zinc orthophosphate dihydrate Zinc orthoposphate tetrahydrate Zinc bromide ion(+1) Zinc bromide Zinc bromide dihydrate Zinc tribromide ion(-1) Zinc monoglycine ion(+1) Zinc oxalate Zinc oxalate dihydrate Zinc chloride ion(+1) Zinc chloride Zinc chloride monohydrate Zinc chloride trihydrate Zinc dichloride pentoxide Zinc dichloride pentoxide octahydrate Zinc trichloride ion(-1) Zinc monocyanide ion(+1) Zinc carbonate
Aspen HYSYSOLI Interface Name ZNMDEXHION ZNCTRTION ZNNTAION ZNNTA2ION ZNH2EDTA ZNH2DTPAION ZNH2CTRTION ZNH3DTPA ZNHEDTAION ZNHDTPAION ZNHCTRT ZNHNTA ZNCOOHION ZNCOOH2 ZNCOOH2.2H2O ZNION ZN2DTPAION ZN3PO42 ZN3PO42.1H2O ZN3PO42.2H2O ZN3PO42.4H2O ZNBRION ZNBR2 ZNBR2.2H2O ZNBR3ION ZNGLYCINION ZNC2O4 ZNC2O4.2H2O ZNCLION ZNCL2 ZNCL2.1H2O ZNCL2.3H2O ZN6CL2O5 ZN6CL2O5.8H2O ZNCL3ION ZNCNION ZNCO3
A-135
A-136
Formula ZnF+1 ZnF2 ZnF2.4H2O ZnH2PO4+1 ZnHC2O4+1 ZnHCO3+1 ZnHPO4 ZnI+1 ZnI2 ZnI2.2H2O ZnMoO4 ZnNH3+2 ZnNO3+1 ZnOH+1 ZnS ZnSCN+1 ZnSe ZnSeO3 ZnSeO3.2H2O ZnSeO3.H2O ZnSeO4 ZnSeO4.6H2O ZnSeO4.H2O ZnSO3 ZnSO4 ZnSO4.1H2O ZnSO4.6H2O ZnSO4.7H2O ZnWO4 Zr Zr(C2O4)2 Zr(NO3)2+2 Zr(OH)[C6H6NO6] Zr(OH)2+2 Zr(OH)3+1 Zr(OH)4 Zr(OH)5-1 Zr(SO4)2
Common/IUPAC Name Zinc monofluoride ion(+1) Zinc fluoride Zinc fluoride tetrahydrate Zinc dihydrogen orthophosphate ion(+1) Zinc hydrogen oxalate ion(+1) Zinc bicarbonate ion(+1) Zinc hydrogen orthophosphate Zinc monoiodide ion(+2) Zinc iodide Zinc iodide dihydrate Zinc molybdate(VI) Zinc monoammonia ion(+2) Zinc nitrate ion(+1) Zinc monohydroxide ion(+1) Zinc sulfide Zinc monothiocyanate ion(+1) Zinc selenide Zinc selenite Zinc selenite dihydrate Zinc selenite monohydrate Zinc selenate Zinc selenate hexahydrate Zinc selenate monohydrate Zinc sulfite Zinc sulfate Zinc sulfate monohydrate Zinc sulfate hexahydrate Zinc sulfate heptahydrate Zinc tungstate(VI) Zirconium Zirconium oxalate Zirconium dinitrate ion(+2) Zirconium hydroxide NTA Zirconium dihydroxide ion(+2) Zirconium trihydroxide ion(+1) Zirconium hydroxide Zirconium pentahydroxide ion(-1) Zirconium sulfate
Aspen HYSYSOLI Interface Name ZNFION ZNF2 ZNF2.4H2O ZNH2PO4ION ZNHC2O4ION ZNHCO3ION ZNHPO4 ZNIION ZNI2 ZNI2.2H2O ZNMOO4 ZNNH3ION ZNNO3ION ZNOHION ZNS ZNSCNION ZNSE ZNSEO3 ZNSEO3.2H2O ZNSEO3.1H2O ZNSEO4 ZNSEO4.6H2O ZNSEO4.1H2O ZNSO3 ZNSO4 ZNSO4.1H2O ZNSO4.6H2O ZNSO4.7H2O ZNWO4 ZREL ZRC2O42 ZRNO32ION ZROHNTA ZROH2ION ZROH3ION ZROH4 ZROH5ION ZRSO42
A-136
Formula Zr(SO4)2.4H2O Zr[C10H12N2O8] Zr[C6H6NO6]+1 Zr+4 ZrBr4 ZrC2O4+2 ZrCl+3 ZrCl2+2 ZrCl3+1 ZrCl4 ZrF+3 ZrF2+2 ZrF3+1 ZrF4 ZrF4.1H2O ZrF4.3H2O ZrF5-1 ZrF6-2 ZrI4 ZrNO3+3 ZrO2 ZrOCl2 ZrOCl2.2H2O ZrOCL2.3.5H2O ZrOCl2.6H2O ZrOCl2.8H2O ZrOH+3 ZrS2 ZrSO4+2 ZrSO42.1H2O
Common/IUPAC Name Zirconium sulfate tetrahydrate Zirconium EDTA Zirconium NTA ion(+1) Zirconium ion(+4) Zirconium bromide Zirconium monooxalate ion(+2) Zirconium monochloride ion(+3) Zirconium dichloride ion(+2) Zirconium trichloride ion(+1) Zirconium tetrachloride Zirconium monofluoride ion(+3) Zirconium difluoride ion(+2) Zirconium trifluoride ion(+1) Zirconium fluoride Zirconium fluoride monohydrate Zirconium fluoride trihydrate Zirconium pentafluoride ion(-1) Zirconium hexafluoride ion(-2) Zirconium iodide Zirconium mononitrate ion(+3) Zirconium oxide Zirconium oxide dichloride Zirconium oxide dichloride dihydrate Zirconium oxide dichloride 3.5 hydrate Zirconium oxide dichloride hexahydrate Zirconium oxide dichloride octahydrate Zirconium monohydroxide ion(+3) Zirconium sulfide Zirconium sulfate ion(+2) Zirconium sulfate monohydrate
Aspen HYSYSOLI Interface Name ZRSO42.4H2O ZREDTA ZRNTAION ZRION ZRBR4 ZRC2O4ION ZRCLION ZRCL2ION ZRCL3ION ZRCL4 ZRFION ZRF2ION ZRF3ION ZRF4 ZRF4.1H2O ZRF4.3H2O ZRF5ION ZRF6ION ZRI4 ZRNO3ION ZRO2 ZROCL2 ZROCL2.2H2O ZROCL2.3.5H2O ZROCL2.6H2O ZROCL2.8H2O ZROHION ZRS2 ZRSO4ION ZRSO42.1H2O
A-137
A-138
A-138
Aspen HYSYS-OLI Interface GEOCHEM Database B-
Aspen HYSYS-OLI Interface GEOCHEM Database

B.1 List of Aspen HYSYS-OLI Interface GEOCHEM Database................. 2
B-1
B-2
List of Aspen HYSYS-OLI Interface
B.1 List of Aspen HYSYSOLI Interface GEOCHEM Database

The GEOCHEM database is seperated from the full database. It contains many solids that only form via thermodynamic equilibrium after long periods of time (thousands of years). These solids form in nature and are often different from the form of a solid, made up of the same elements, that may form in a much shorter amount of time (usually instantly) within a process. Thus, the GEOCHEM solids tend to form through aging of the aqueous environment in contact with a source of the elements comprising the solids. The following list includes the Aspen HYSYS-OLI Interface Name, Formula and the Common/ IUPAC name. To find or match an electrolyte component in Aspen HYSYS, select the GEOCHEM checkbox in the Full database and then select the appropriate component or type in the Aspen HYSYS-OLI Interface name.
Aspen HYSYSOLI Interface Name CA12AL14O33 AL2O3 KAOLINITE AL2SILICAT ANDALUSITE KYANITE SILLIMANIT DIASPORE BA2SIO4 BASIO3 BI2O3 WAIRAKITE.2H2O
Formula 12CaO.7Al2O3 Al2O3 Al2Si2O5(OH)4 Al2Si4O10(OH)2 Al2SiO5 Al2SiO5 Al2SiO5 AlO(OH) Ba2SiO4 BaSiO3 Bi2O3 Ca(Al2Si4O12).2H2O
Common/IUPAC Name Dodecacalcium tetradecaaluminum tritriacontaoxide Aluminum oxide Dialuminum disilicon pentaoxide tetrahydroxide Dialuminum tetrasilicon decaoxide dihydroxide Dialuminum silicon pentaoxide Dialuminum silicon pentaoxide Dialuminum silicon pentaoxide Aluminum oxide hydroxide Dibarium silicon tetraoxide Barium silicon trioxide Bismuth oxide Calcium dialuminum tetrasilicon dodecaoxide dihydrate
B-2
Aspen HYSYS-OLI Interface GEOCHEM
Formula Ca2Al2Si3O10(OH)2 Ca2Al2SiO7 Ca2Al3Si3O12(OH) Ca2Al3Si3O12(OH) Ca2Mg5Si8O22(OH)2 Ca2MgSi2O7 Ca2SiO4 Ca2SiO4 Ca3Al2(SiO4)3 Ca3Fe2Si3O12 Ca3MgSi2O8 Ca5(OH)(PO4)3 CaAl2(Al2Si2O10)(OH)2 CaAl2Si2O7(OH)2 CaAl2Si2O7(OH)2.1H2O CaAl2Si2O8 CaAl2Si4O12 CaAl2Si4O12 CaAl2Si4O12.4H2O CaAl2SiO6 CaCO3 CaFe2O4 CaFeSi2O6 CaMg(CO3)2 CaMg(CO3)2 CaMg(CO3)2 CaMg3(CO3)4 CaMgSi2O6 CaMgSi2O6 CaMgSiO4
Common/IUPAC Name Dicalcium dialuminum trisilicon decaoxide dihydroxide Dicalcium dialuminum silicon heptaoxide Dicalcium trialuminum trisilicon dodecaoxide hydroxide Dicalcium trialuminum trisilicon dodecaoxide hydroxide Dicalcium pentamagnesium octasilicon docosaoxide dihydroxide Dicalcium magnesium disilicon heptaoxide Dicalcium silicon tetraoxide Dicalcium silicon tetraoxide Tricalcium dialuminum trisilicon dodecaoxide Tricalcium diiron trisilicon dodecaoxide Tricalcium magnesium disilicon octaoxide Pentacalcium hydroxide phosphate Calcium tetraaluminum disilicon decaoxide dihydroxide Calcium dialuminum disilicon heptaoxide dihydroxide Calcium dialuminum disilicon heptaoxide dihydroxide monohydrate Calcium dialuminum disilicon octaoxide Calcium dialuminum tetrasilicon dodecaoxide Calcium dialuminum tetrasilicon dodecaoxide Calcium dialuminum tetrasilicon dodecaoxide tetrahydrate Calcium dialuminum silicon hexaoxide Calcium carbonate Calcium diiron tetraoxide Calcium iron disilicon hexaoxide Calcium magnesium carbonate Calcium magnesium carbonate Calcium magnesium carbonate Calcium trimagnesium carbonate Calcium magnesium disilicon hexaoxide Calcium magnesium disilicon hexaoxide Calcium magesium silicon tetraoxide
Aspen HYSYSOLI Interface Name PREHNITE CA2AL2SIO7 CLINZOISIT ZOISITE TREMOLITE CA2MGSI2O7 CA2SIO4 OLIVINE GROSSULAR ANDRADITE CA3MGSIO42 CA5OHPO43 MARGARITE LAWSONITE LAWSONITE.1H2O CAAL2SI2O8 LMNTITE WAIRAKITE LMNTITE.4H2O CAALALSIO6 ARAGONITE CAFE2O4 CAFESIO32 DISDOL DOLOMITE ORDDOL CAMG3CO34 DIOPSIDE CAMGSIO32 CAMGSIO4
B-3
B-4
Formula CaO CaSiO3 CaSiO3 CaTiSiO5 CdSiO3 Co2SiO4 Cr2O3 Cu2(OH)2CO3 Cu3(OH)2(CO3)2 Cu5FeS4 CuFeS2 CuO Dy2O3 Er2O3 Eu2O3 EuO Fe2O3 Fe2SiO4 Fe3O4 FeO FeO(OH) FeSiO3 Gd2O3 Ho2O3 K2O K2Si2O5 K2SiO3 KAl3(OH)6(SO4)2 KAl3Si3O10(OH)2 KAlSi3O8 KAlSi3O8 KAlSi3O8 KAlSiO4 La2O3 Lu2O3 Mg2(OH)2CO3
Common/IUPAC Name Calcium oxide Calcium silicon trioxide Calcium silicon trioxide Calcium titanium silicon pentaoxide Cadmium silicon trioxide Dicobalt silicon tetraoxide Chromium(III) oxide Dicopper dihydroxide carbonate Tricopper dihydroxide dicarbonate Pentacopper(I) iron(III) tetrasulfide Copper(II) iron(II) disulfide Copper(II) oxide Dysprosium oxide Erbium oxide Europium oxide Europium(II) oxide Iron(III) oxide Diiron silicon tetraoxide Triiron tetraoxide Iron(II) oxide Iron(III) oxide hydroxide Iron silicon trioxide Gadolinium oxide Holmium oxide Potassium oxide Dipotassium disilicon pentaoxide Dipotassium silicon trioxide Potassium trialuminum hexahydroxide sulfate Potassium trialuminum trisilicon decaoxide dihydroxide Potassium aluminum trisilicon octaoxide Potassium aluminum trisilicon octaoxide Potassium aluminum trisilicon octaoxide Potassium aluminum silicon tetraoxide Lanthanum oxide Lutetium oxide Dimagnesium dihydroxide carbonate
Aspen HYSYSOLI Interface Name CAO CASIO3 PWOLLAST SPHENE CDSIO3 CO2SIO4 CR2O3 CU2OH2CO3 CU3OH2CO32 CU5FEIIIS4 CUFEIIS2 CUO DY2O3 ER2O3 EU2O3 EUIIO FEIII2O3 FEII2SIO4 MAGNETITE FEIIO FEOOH FEIISIO3 GD2O3 HO2O3 K2O K2SI2O5 K2SIO3 KAL3SULFAT MUSCOVITE KALSI3O8 KFELDSPAR MAXMIC KALSIO4 LA2O3 LU2O3 MG2OH2CO3
B-4
Formula Mg2(OH)2CO3.3H2O Mg2Al3(AlSi5O18) Mg2Al3(AlSi5O18) Mg2Al3(AlSi5O18).1H2O Mg2SiO4 Mg2SiO4 Mg3Al2Si3O12 Mg3Si2O5(OH)4 Mg3Si2O5(OH)4 Mg3Si4O10(OH)2 Mg4[Si6O15(OH)2(H2O)2]. 3H2O Mg48Si35O85(OH)62
Common/IUPAC Name Dimagnesium dihydroxide carbonate trihydrate Dimagnesium tetraaluminum pentasilicon octadecaoxide Dimagnesium tetraluminum pentasilicon octadecaoxide Dimagnesium tetraluminum pentasilicon dodecaoxide monohydrate Dimagnesium silicon tetraoxide Dimagnesium silicon tetraoxide Trimagnesium dialuminum trisilicon dodecaoxide Trimagnesium disilicon pentaoxide tetrahydroxide Trimagnesium disilicon pentaoxide tetrahydroxide Trimagnesium tetrasilicon decaoxide dihydroxide Tetramagnesium hexasilicon pentadecaoxide dihydroxide pentahydrate Octatetracontamagnesium pentatricontasilicon pentaoctacontaoxide 62hy Pentamagnesium dihydroxide carbonate tetrahydrate Pentamagnesium dialuminum trisilicon decaoxide octahydroxide Pentamagnesium dialuminum trisilicon decaoxide octahydroxide Heptamagnesium disilicon octaoxide dihydroxide Magnesium dialuminum tetraoxide Magnesium diiron teraoxide Magnesium oxide Magnesium silicon trioxide Magnesium silicon trioxide Dimanganese silicon tetraoxide Manganese(II) oxide Manganese silicon trioxide Disodium oxide Disodium disilicon pentaoxide Disodium silicon trioxide octahydrate
Aspen HYSYSOLI Interface Name MG2OH2CO3.3H2O CORDIERIT HYDCORD HYDCORD.1H2O FORSTERITE MG2SIO4 PYROPE CHRYSOTILE MG3SILICAT TALC SEPIOLITE
ANTIGORITE
Mg5(OH)2(CO3)4.4H2O Mg5Al(AlSi3O10)(OH)8 Mg5Al[AlSi3O10(OH)2](OH) 6 Mg7Si2O8(OH)2 MgAl2O4 MgFe2O4 MgO MgSiO3 MgSiO3 Mn2SiO4 MnO MnSiO3 Na2O Na2Si2O5 Na2SiO3.8H2O
MAGNESITE CL7A CL14A MG7SILICAT MGAL2O4 MGFE2O4 MGO ENSTATITE MGSIO3 MN2SIO4 MNO MNSIO3 NA2O NA2SI2O5 NA2SIO3.8H2O
B-5
B-6
Formula Na4SiO4 NaAl3Si3O10(OH)2 NaAlSi2O6 NaAlSi2O6 NaAlSi2O6.1H2O NaAlSi3O8 NaAlSi3O8 NaAlSi3O8 NaAlSiO4 NaFe3(SO4)2(OH)6 NaFeSi2O6 Nd2O3 NiO Pb(OH)2 PbSiO3 PdO Pr2O3 SiO2 SiO2 SiO2 SiO2 Sm2O3 SnO SnO2 SnS SnS2 Sr2SiO4 SrSiO3 TiO2 USiO4 Yb2O3 Zn(OH)2 Zn2SiO4 ZnCl2.4Zn(OH)2 ZnCl2.4Zn(OH)2.1H2O ZnO
Common/IUPAC Name Tetrasodium silicon tetraoxide Sodium trialuminum trisilicon decaoxide dihydroxide Sodium aluminum disilicon hexaoxide Sodium aluminum disilicon hexaoxide Sodium aluminum disilicon hexaoxide monohydrate Sodium aluminum trisilicon octaoxide Sodium aluminum trisilicon octaoxide Sodium aluminum trisilicon octaoxide Sodium aluminum silicon tetraoxide Sodium triiron(III) hexahydroxide sulfate Sodium iron disilicon hexaoxide Neodymium oxide Nickel(II) oxide Lead(II) hydroxide Lead silicon trioxide Palladium(II) oxide Praseodymium oxide Silicon dioxide Silicon dioxide Silicon dioxide Silicon dioxide Samarium oxide Tin(II) oxide Tin(IV) oxide Tin(II) sulfide Tin(IV) disulfide Strontium silicon tetraoxide Strontium silicon trioxide Titanium(IV) oxide Uranium silicon tetraoxide Ytterbium oxide Zinc hydroxide Dizinc silicon tetraoxide Pentazinc octahydroxide dichloride Pentazinc octahydroxide dichloride monohydrate Zinc oxide
Aspen HYSYSOLI Interface Name NA4SIO4 PARAGONITE NAALSI2O6 NAALSIO32 NAALSI2O6.1H2O ALBITE HIGHALBITE LOWALBITE NAALSIO4 NAJAROSITE AEGERINE ND2O3 NIO PBOH2 PBSIO3 PDO PR2O3 ACRIST CHALCEDONY COESITE QUARTZ SM2O3 SNO SNO2 SNS SNS2 SR2SIO4 SRSIO3 RUTILE USIO4 EYB2O3 ZNOH2EPS ZN2SIO4 ZN5CLOH ZN5CLOH.1H2O ZNO
B-6
Formula ZnO.FE2O3 ZnS ZnSiO3 ZrSiO4
Common/IUPAC Name Zinc diiron(III) tetraoxide Zinc sulfide Zinc silicon trioxide Zirconium silicon teraoxide
Aspen HYSYSOLI Interface Name ZNFE2O4 WURTZITE ZNSIO3 ZRSIO4
B-7
B-8
B-8
Index
A Activity Bromley-Meissner 3-12 Bromley-Zemaitis 3-13 Helgeson 3-14 Pitzer 3-17 Setschenow 3-16 Activity Coefficients 1-18, 3-11 Aqueous Thermodynamics 1-16, 3-2 B Bromely-Zemaitis 1-18 C Column Operations 1-28 Column Specifications 1-30 Complexes 1-8 organo-metallic 1-8 Components 1-21 Full databank 1-38 GEOCHEM 1-39 D Debye-Huckel 1-18 E Enthalpy 1-14 Helgeson 3-7 Partial Molal 3-4 Entropy 1-14 Helgeson 3-8 Partial Molal 3-4 Equation of State Bromley-Zemaitis 3-12 Helgeson 3-7 Helgeson-Kirkham-Flowers 3-5 HKF 3-5 Pitzer 3-14 Equilibrium Constant 3-2 Excess Gibbs Free Energy 3-10 Excess Properties 3-10 F Flash Stream 1-32 G Gibbs Free Energy 1-14, 1-19 Excess 1-16 Helgeson 3-7 Partial Molal 3-3 Standard State 1-15 Total 1-15, 3-3 H Heat Capacity 1-14 Helgeson 3-8 Partial Molal 3-4 I Ionic Strength 1-25, 3-11 M Mol Fraction Limitations 1-34 Multi-Component Systems Limitations 1-35 Multiphase Model 3-17 N Neutral Species 3-15 Nomenclature 1-23 O OLI Dataservice 1-43 OLI Engine 1-44 OLI specs 1-31 OLI Thermodynamics 1-17 Osmotic Pressure 1-26 Other Physical Phases 1-19 Gas phase 1-19 Second non-aqueous liquid phase 1-19 P pH 1-25 Plots 1-29 Pressure Limitations 1-34 Process Applications 1-11 Properties 1-25 Pump Arounds 1-30 S Scaling Tendencies 1-28, 3-20
I-1
I-2
Solid Phase 1-19 Solubility 1-8 Solubility Prediction 2-2 Speciation 1-6 Sour Water 2-7 Specifications Column 1-30 OLI 1-31 Standard State 3-9 Systems 1-9 High Ionic 1-9 T Temperature Limitations 1-34 Thermodynamic Properties 3-3 Total Condenser 1-30 TRANGE 3-22 Tray Efficiencies 1-30 V Volume 1-14 Helgeson 3-7 Partial Molal 3-4
I-2

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Aspen HYSYS

Version Number: V7.3 March 2011

Aspen HYSYS-OLI Interface

Aspen HYSYS-OLI Interface

Aspen HYSYS-OLI Interface

1.9 OLI Engine....................................................................................45

Aspen HYSYS-OLI Interface

Note: Installing Aspen HYSYS OLI Interface for V7.2

Aspen HYSYS-OLI Interface

1.2 Aqueous Electrolyte Systems

Aqueous Electrolyte Systems

1.2.1 Speciation of Aqueous Electrolytes

FeCl3 + Cl- = FeCl4Fe3+ + OH- = FeOH2+

FeOH2+ + OH- = FeOH2+ FeOH2+ + OH- = FeOH3 FeOH3 + OH- = FeOH4-

+ Cl = FeCl2 + Cl= FeCl3

Aspen HYSYS-OLI Interface

NH2CO2- + H2O = NH4+ + CO32H2S = H+ + HSHS- = H+ + S2OH2-

Aqueous Electrolyte Systems

below with some points exceeding three orders of magnitude.

Aspen HYSYS-OLI Interface

1.2.2 High Ionic Strength Systems

Aqueous Electrolyte Systems

( = 1 ) assumption can lead to substantial errors as shown in the figure below.

Aspen HYSYS-OLI Interface

Aqueous Electrolyte Systems

1.2.3 Process Application

Aspen HYSYS-OLI Interface

Aqueous Electrolyte Systems

Aspen HYSYS-OLI Interface

1.3 Gibbs Free Energy

Gibbs Free Energy

An example of such a reaction is shown below.

where: G = Total Gibbs Free Energy

Aspen HYSYS-OLI Interface

OLI Thermodynamic Framework

1.4 OLI Thermodynamic Framework

Aspen HYSYS-OLI Interface

Other Physical Phases in

1.5 Other Physical Phases in Equilibrium

where: Tr = reference state temperature of 298.15 K

Aspen HYSYS-OLI Interface

1.6 Aspen HYSYSOLI_Electrolyte Property Package

1.6.1 Electrolyte Calculation Techniques

1.6.2 Electrolyte Components

Aspen HYSYS-OLI Interface

1.6.3 Chemistry Model Generation

1.6.4 Electrolytes Nomenclature

Aspen HYSYS-OLI Interface

1.6.5 Electrolyte Properties

pH = log [ H 3 O ] 1 pH = log -----------------+ [ H3 O ]

Aspen HYSYS-OLI Interface

Property Osmotic Pressure

Property Specific Electrical Conductivity

Description The specific electrical conductivity is expressed in the following relation:

Molar Electrical Conductivity

The molar electrical conductivity is expressed in the following relation:

where: Ls = specific electrical conductivity CN = concentration of the electrolyte solution

1.6.6 Disabling Solid Components

Aspen HYSYS-OLI Interface

1.6.7 Scaling Tendencies

1.6.8 Aspen HYSYS Column Operation

Aspen HYSYS-OLI Interface

Basic Column Configurations