LrgpV1, Main, Exploration, bibRecord, 000300

Experimental and theoretical study of interaction between organic compounds and 1-(4-sulfobutyl)-3-methylimidazolium based ionic liquids

Identifieur interne : 000300 ( Main/Exploration ); précédent : 000299; suivant : 000301

Experimental and theoretical study of interaction between organic compounds and 1-(4-sulfobutyl)-3-methylimidazolium based ionic liquids

Auteurs : Zehor Bensaid [Algérie] ; Fabrice Mutelet [France] ; Mohammed Bouroukba [France] ; Amina Negadi [Algérie]

Source :

Fluid Phase Equilibria [ 0378-3812 ] ; 2014-09.

RBID : Hal:hal-01274183

Abstract

Activity coefficients at infinite dilution (gamma(infinity)(1,2)) for diverse probe solutes in three homologous 1-(4-sulfobutyl)-3-methylimidazolium based ionic liquids were measured by inverse gas chromatography at temperatures from 323 to 343 K. Accordingly, this family of ionic liquid can be ranked according to their interaction with organic compounds as follows: [HSO4] << [OTf] << [N(Tf)(2)]. The retention data were further converted to gas-to-IL and analyzed using the Abraham solvation parameter model. The LSER treatment indicates that the most dominant interaction constants for this family of ILs are strong dipolarity, hydrogen bond basicity and acidity. Then, the ChelpG atomic charges on the cation and the anions obtained by ab initio calculations are used to explain the interactions between methanol, thiophene and benzene and the anions or the cation.

Url:

https://hal.univ-lorraine.fr/hal-01274183

DOI: 10.1016/j.fluid.2014.06.021

Affiliations:

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<front><div type="abstract" xml:lang="en">Activity coefficients at infinite dilution (gamma(infinity)(1,2)) for diverse probe solutes in three homologous 1-(4-sulfobutyl)-3-methylimidazolium based ionic liquids were measured by inverse gas chromatography at temperatures from 323 to 343 K. Accordingly, this family of ionic liquid can be ranked according to their interaction with organic compounds as follows: [HSO4] << [OTf] << [N(Tf)(2)]. The retention data were further converted to gas-to-IL and analyzed using the Abraham solvation parameter model. The LSER treatment indicates that the most dominant interaction constants for this family of ILs are strong dipolarity, hydrogen bond basicity and acidity. Then, the ChelpG atomic charges on the cation and the anions obtained by ab initio calculations are used to explain the interactions between methanol, thiophene and benzene and the anions or the cation.</div>
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Experimental and theoretical study of interaction between organic compounds and 1-(4-sulfobutyl)-3-methylimidazolium based ionic liquids

Experimental and theoretical study of interaction between organic compounds and 1-(4-sulfobutyl)-3-methylimidazolium based ionic liquids

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Abstract

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Le document en format XML

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