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Gutmann’s Donor and Acceptor Numbers for Ionic Liquids and Deep Eutectic Solvents
An experimental and computational methodology for the analysis of the Lewis acid/base responses of ionic liquids (ILs) and deep eutectic solvents (DES) is proposed. It is based on the donor and acceptor of the electronic charge ability of Lewis acid and bases concepts (donicity and acceptor numbers,...
Autores principales: | , , |
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Formato: | Online Artículo Texto |
Lenguaje: | English |
Publicado: |
Frontiers Media S.A.
2022
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Materias: | |
Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC9008452/ https://www.ncbi.nlm.nih.gov/pubmed/35433634 http://dx.doi.org/10.3389/fchem.2022.861379 |
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author | Sanchez, Bruno Campodónico, Paola R. Contreras, Renato |
author_facet | Sanchez, Bruno Campodónico, Paola R. Contreras, Renato |
author_sort | Sanchez, Bruno |
collection | PubMed |
description | An experimental and computational methodology for the analysis of the Lewis acid/base responses of ionic liquids (ILs) and deep eutectic solvents (DES) is proposed. It is based on the donor and acceptor of the electronic charge ability of Lewis acid and bases concepts (donicity and acceptor numbers, DN and AN, respectively) proposed by Viktor Gutmann. The binding enthalpy between the IL/DES with the probe antimony pentachloride (SbCl(5)) in dichloroethane displays good correlations with experimental data. This approach could serve as a first approximation to predict the responses to H-bonding abilities of new IL or DES. Although useful, the problems encountered to model the electron AN of these solvents limit the usefulness of the approach to completely describe their polarity properties. The experimental data were recorded using UV–Vis spectroscopy for a wide range of ILs and a couple of DES. Two reactions were used as benchmarks to test the reliability of the DN model to discuss the reactivity of real systems in these neoteric solvents. |
format | Online Article Text |
id | pubmed-9008452 |
institution | National Center for Biotechnology Information |
language | English |
publishDate | 2022 |
publisher | Frontiers Media S.A. |
record_format | MEDLINE/PubMed |
spelling | pubmed-90084522022-04-15 Gutmann’s Donor and Acceptor Numbers for Ionic Liquids and Deep Eutectic Solvents Sanchez, Bruno Campodónico, Paola R. Contreras, Renato Front Chem Chemistry An experimental and computational methodology for the analysis of the Lewis acid/base responses of ionic liquids (ILs) and deep eutectic solvents (DES) is proposed. It is based on the donor and acceptor of the electronic charge ability of Lewis acid and bases concepts (donicity and acceptor numbers, DN and AN, respectively) proposed by Viktor Gutmann. The binding enthalpy between the IL/DES with the probe antimony pentachloride (SbCl(5)) in dichloroethane displays good correlations with experimental data. This approach could serve as a first approximation to predict the responses to H-bonding abilities of new IL or DES. Although useful, the problems encountered to model the electron AN of these solvents limit the usefulness of the approach to completely describe their polarity properties. The experimental data were recorded using UV–Vis spectroscopy for a wide range of ILs and a couple of DES. Two reactions were used as benchmarks to test the reliability of the DN model to discuss the reactivity of real systems in these neoteric solvents. Frontiers Media S.A. 2022-03-31 /pmc/articles/PMC9008452/ /pubmed/35433634 http://dx.doi.org/10.3389/fchem.2022.861379 Text en Copyright © 2022 Sanchez, Campodónico and Contreras. https://creativecommons.org/licenses/by/4.0/This is an open-access article distributed under the terms of the Creative Commons Attribution License (CC BY). The use, distribution or reproduction in other forums is permitted, provided the original author(s) and the copyright owner(s) are credited and that the original publication in this journal is cited, in accordance with accepted academic practice. No use, distribution or reproduction is permitted which does not comply with these terms. |
spellingShingle | Chemistry Sanchez, Bruno Campodónico, Paola R. Contreras, Renato Gutmann’s Donor and Acceptor Numbers for Ionic Liquids and Deep Eutectic Solvents |
title | Gutmann’s Donor and Acceptor Numbers for Ionic Liquids and Deep Eutectic Solvents |
title_full | Gutmann’s Donor and Acceptor Numbers for Ionic Liquids and Deep Eutectic Solvents |
title_fullStr | Gutmann’s Donor and Acceptor Numbers for Ionic Liquids and Deep Eutectic Solvents |
title_full_unstemmed | Gutmann’s Donor and Acceptor Numbers for Ionic Liquids and Deep Eutectic Solvents |
title_short | Gutmann’s Donor and Acceptor Numbers for Ionic Liquids and Deep Eutectic Solvents |
title_sort | gutmann’s donor and acceptor numbers for ionic liquids and deep eutectic solvents |
topic | Chemistry |
url | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC9008452/ https://www.ncbi.nlm.nih.gov/pubmed/35433634 http://dx.doi.org/10.3389/fchem.2022.861379 |
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