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2,4-Dichloro­anilinium 4-chloro­benzene­sulfonate monohydrate

The asymmetric unit of the title compound, C(6)H(6)Cl(2)N(+)·C(6)H(4)ClO(3)S(−)·H(2)O, contains two 2,4-dichloro­anilinium cations, two 4-chloro­phenyl­sulfonate anions and two water mol­ecules. The three H atoms of the positively charged NH(3) group have two O atoms of the negatively charged sulfon...

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Autores principales: Shakuntala, K., Foro, Sabine, Gowda, B. Thimme
Formato: Texto
Lenguaje:English
Publicado: International Union of Crystallography 2011
Materias:
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3089207/
https://www.ncbi.nlm.nih.gov/pubmed/21754400
http://dx.doi.org/10.1107/S1600536811012463
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author Shakuntala, K.
Foro, Sabine
Gowda, B. Thimme
author_facet Shakuntala, K.
Foro, Sabine
Gowda, B. Thimme
author_sort Shakuntala, K.
collection PubMed
description The asymmetric unit of the title compound, C(6)H(6)Cl(2)N(+)·C(6)H(4)ClO(3)S(−)·H(2)O, contains two 2,4-dichloro­anilinium cations, two 4-chloro­phenyl­sulfonate anions and two water mol­ecules. The three H atoms of the positively charged NH(3) group have two O atoms of the negatively charged sulfonate anion and one O atom of the water mol­ecule as acceptors. Similarly, the two H atoms of the water mol­ecule have two O atoms of two different negatively charged sulfonate anions as acceptors. Further, one of the O atoms of the sulfonate anion is involved in simultaneous hydrogen bonds with two H atoms, one from the positively charged NH(3) group and the other from the water mol­ecule. In the crystal, mol­ecules are packed into a layer structure through N—H⋯O(S), N—H⋯O(H(2)O) and N—H⋯O(S)⋯H—O(H(2)O) (three-centre) hydrogen bonding, the chains running along the c axis.
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spelling pubmed-30892072011-07-13 2,4-Dichloro­anilinium 4-chloro­benzene­sulfonate monohydrate Shakuntala, K. Foro, Sabine Gowda, B. Thimme Acta Crystallogr Sect E Struct Rep Online Organic Papers The asymmetric unit of the title compound, C(6)H(6)Cl(2)N(+)·C(6)H(4)ClO(3)S(−)·H(2)O, contains two 2,4-dichloro­anilinium cations, two 4-chloro­phenyl­sulfonate anions and two water mol­ecules. The three H atoms of the positively charged NH(3) group have two O atoms of the negatively charged sulfonate anion and one O atom of the water mol­ecule as acceptors. Similarly, the two H atoms of the water mol­ecule have two O atoms of two different negatively charged sulfonate anions as acceptors. Further, one of the O atoms of the sulfonate anion is involved in simultaneous hydrogen bonds with two H atoms, one from the positively charged NH(3) group and the other from the water mol­ecule. In the crystal, mol­ecules are packed into a layer structure through N—H⋯O(S), N—H⋯O(H(2)O) and N—H⋯O(S)⋯H—O(H(2)O) (three-centre) hydrogen bonding, the chains running along the c axis. International Union of Crystallography 2011-04-07 /pmc/articles/PMC3089207/ /pubmed/21754400 http://dx.doi.org/10.1107/S1600536811012463 Text en © Shakuntala et al. 2011 http://creativecommons.org/licenses/by/2.0/uk/ This is an open-access article distributed under the terms of the Creative Commons Attribution Licence, which permits unrestricted use, distribution, and reproduction in any medium, provided the original authors and source are cited.
spellingShingle Organic Papers
Shakuntala, K.
Foro, Sabine
Gowda, B. Thimme
2,4-Dichloro­anilinium 4-chloro­benzene­sulfonate monohydrate
title 2,4-Dichloro­anilinium 4-chloro­benzene­sulfonate monohydrate
title_full 2,4-Dichloro­anilinium 4-chloro­benzene­sulfonate monohydrate
title_fullStr 2,4-Dichloro­anilinium 4-chloro­benzene­sulfonate monohydrate
title_full_unstemmed 2,4-Dichloro­anilinium 4-chloro­benzene­sulfonate monohydrate
title_short 2,4-Dichloro­anilinium 4-chloro­benzene­sulfonate monohydrate
title_sort 2,4-dichloro­anilinium 4-chloro­benzene­sulfonate monohydrate
topic Organic Papers
url https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3089207/
https://www.ncbi.nlm.nih.gov/pubmed/21754400
http://dx.doi.org/10.1107/S1600536811012463
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