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2-(2,5-Dichlorobenzenesulfonamido)-3-methylbutanoic acid
The structure of the title compound, C(11)H(13)Cl(2)NO(4)S, shows one sulfonamide-O atom to lie almost in the plane of the benzene ring [C—C—S—O = −178.7 (2) °] and the other to one side [C—C—S—O = −49.4 (3)°]. Lying to the other side is the amine residue, which occupies a position almost perpendicu...
Autores principales: | , , , , |
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Formato: | Texto |
Lenguaje: | English |
Publicado: |
International Union of Crystallography
2010
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Materias: | |
Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3009271/ https://www.ncbi.nlm.nih.gov/pubmed/21589068 http://dx.doi.org/10.1107/S1600536810041620 |
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author | Khan, Islam Ullah John, Peter Iqbal, Haffsah Sharif, Shahzad Tiekink, Edward R. T. |
author_facet | Khan, Islam Ullah John, Peter Iqbal, Haffsah Sharif, Shahzad Tiekink, Edward R. T. |
author_sort | Khan, Islam Ullah |
collection | PubMed |
description | The structure of the title compound, C(11)H(13)Cl(2)NO(4)S, shows one sulfonamide-O atom to lie almost in the plane of the benzene ring [C—C—S—O = −178.7 (2) °] and the other to one side [C—C—S—O = −49.4 (3)°]. Lying to the other side is the amine residue, which occupies a position almost perpendicular to the plane [C—S—N—C = 70.2 (2)°]; the carboxylic acid group is orientated to lie over the benzene ring. In the crystal, the appearance of an 11-membered {⋯OH⋯OCOH⋯OC(2)NH} synthon, which features the hydroxy group forming both donor (to a carbonyl-O) and acceptor (from the amine-H) interactions, leads to the formation of a supramolecular chain along the a axis. Chains are connected in the crystal structure by C—H⋯O contacts. |
format | Text |
id | pubmed-3009271 |
institution | National Center for Biotechnology Information |
language | English |
publishDate | 2010 |
publisher | International Union of Crystallography |
record_format | MEDLINE/PubMed |
spelling | pubmed-30092712010-12-30 2-(2,5-Dichlorobenzenesulfonamido)-3-methylbutanoic acid Khan, Islam Ullah John, Peter Iqbal, Haffsah Sharif, Shahzad Tiekink, Edward R. T. Acta Crystallogr Sect E Struct Rep Online Organic Papers The structure of the title compound, C(11)H(13)Cl(2)NO(4)S, shows one sulfonamide-O atom to lie almost in the plane of the benzene ring [C—C—S—O = −178.7 (2) °] and the other to one side [C—C—S—O = −49.4 (3)°]. Lying to the other side is the amine residue, which occupies a position almost perpendicular to the plane [C—S—N—C = 70.2 (2)°]; the carboxylic acid group is orientated to lie over the benzene ring. In the crystal, the appearance of an 11-membered {⋯OH⋯OCOH⋯OC(2)NH} synthon, which features the hydroxy group forming both donor (to a carbonyl-O) and acceptor (from the amine-H) interactions, leads to the formation of a supramolecular chain along the a axis. Chains are connected in the crystal structure by C—H⋯O contacts. International Union of Crystallography 2010-10-23 /pmc/articles/PMC3009271/ /pubmed/21589068 http://dx.doi.org/10.1107/S1600536810041620 Text en © Khan et al. 2010 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 Khan, Islam Ullah John, Peter Iqbal, Haffsah Sharif, Shahzad Tiekink, Edward R. T. 2-(2,5-Dichlorobenzenesulfonamido)-3-methylbutanoic acid |
title | 2-(2,5-Dichlorobenzenesulfonamido)-3-methylbutanoic acid |
title_full | 2-(2,5-Dichlorobenzenesulfonamido)-3-methylbutanoic acid |
title_fullStr | 2-(2,5-Dichlorobenzenesulfonamido)-3-methylbutanoic acid |
title_full_unstemmed | 2-(2,5-Dichlorobenzenesulfonamido)-3-methylbutanoic acid |
title_short | 2-(2,5-Dichlorobenzenesulfonamido)-3-methylbutanoic acid |
title_sort | 2-(2,5-dichlorobenzenesulfonamido)-3-methylbutanoic acid |
topic | Organic Papers |
url | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3009271/ https://www.ncbi.nlm.nih.gov/pubmed/21589068 http://dx.doi.org/10.1107/S1600536810041620 |
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