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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...
Autores principales: | , , |
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Formato: | Texto |
Lenguaje: | English |
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International Union of Crystallography
2011
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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. |
format | Text |
id | pubmed-3089207 |
institution | National Center for Biotechnology Information |
language | English |
publishDate | 2011 |
publisher | International Union of Crystallography |
record_format | MEDLINE/PubMed |
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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