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Cyanomethyl 4-(4-methylbenzenesulfonamido)benzoate
The title molecule, C(16)H(14)N(2)O(4)S, adopts an L-shaped conformation, with the central C—S—N—C torsion angle being −69.1 (3)°. The two benzene rings form a dihedral angle of 89.94 (15)°. The molecular conformation may be influenced by a weak intramolecular C—H⋯O hydrogen bond which generates...
Autores principales: | , , , |
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Formato: | Online Artículo Texto |
Lenguaje: | English |
Publicado: |
International Union of Crystallography
2012
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Materias: | |
Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3344598/ https://www.ncbi.nlm.nih.gov/pubmed/22590360 http://dx.doi.org/10.1107/S1600536812017126 |
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author | Mustafa, Ghulam Akkurt, Mehmet Khan, Islam Ullah Muhmood, Tahir |
author_facet | Mustafa, Ghulam Akkurt, Mehmet Khan, Islam Ullah Muhmood, Tahir |
author_sort | Mustafa, Ghulam |
collection | PubMed |
description | The title molecule, C(16)H(14)N(2)O(4)S, adopts an L-shaped conformation, with the central C—S—N—C torsion angle being −69.1 (3)°. The two benzene rings form a dihedral angle of 89.94 (15)°. The molecular conformation may be influenced by a weak intramolecular C—H⋯O hydrogen bond which generates an S(6) ring motif. In the crystal, molecules are linked by N—H⋯O and weak C—H⋯O hydrogen bonds, forming chains propagating along the b axis. Weak C—H⋯N hydrogen bonds connect the chains into a two-dimensional network parallel to (011). The crystal studied was an inversion twin, the ratio of components being 0.7 (1):0.3 (1). |
format | Online Article Text |
id | pubmed-3344598 |
institution | National Center for Biotechnology Information |
language | English |
publishDate | 2012 |
publisher | International Union of Crystallography |
record_format | MEDLINE/PubMed |
spelling | pubmed-33445982012-05-15 Cyanomethyl 4-(4-methylbenzenesulfonamido)benzoate Mustafa, Ghulam Akkurt, Mehmet Khan, Islam Ullah Muhmood, Tahir Acta Crystallogr Sect E Struct Rep Online Organic Papers The title molecule, C(16)H(14)N(2)O(4)S, adopts an L-shaped conformation, with the central C—S—N—C torsion angle being −69.1 (3)°. The two benzene rings form a dihedral angle of 89.94 (15)°. The molecular conformation may be influenced by a weak intramolecular C—H⋯O hydrogen bond which generates an S(6) ring motif. In the crystal, molecules are linked by N—H⋯O and weak C—H⋯O hydrogen bonds, forming chains propagating along the b axis. Weak C—H⋯N hydrogen bonds connect the chains into a two-dimensional network parallel to (011). The crystal studied was an inversion twin, the ratio of components being 0.7 (1):0.3 (1). International Union of Crystallography 2012-04-21 /pmc/articles/PMC3344598/ /pubmed/22590360 http://dx.doi.org/10.1107/S1600536812017126 Text en © Mustafa et al. 2012 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 Mustafa, Ghulam Akkurt, Mehmet Khan, Islam Ullah Muhmood, Tahir Cyanomethyl 4-(4-methylbenzenesulfonamido)benzoate |
title | Cyanomethyl 4-(4-methylbenzenesulfonamido)benzoate |
title_full | Cyanomethyl 4-(4-methylbenzenesulfonamido)benzoate |
title_fullStr | Cyanomethyl 4-(4-methylbenzenesulfonamido)benzoate |
title_full_unstemmed | Cyanomethyl 4-(4-methylbenzenesulfonamido)benzoate |
title_short | Cyanomethyl 4-(4-methylbenzenesulfonamido)benzoate |
title_sort | cyanomethyl 4-(4-methylbenzenesulfonamido)benzoate |
topic | Organic Papers |
url | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3344598/ https://www.ncbi.nlm.nih.gov/pubmed/22590360 http://dx.doi.org/10.1107/S1600536812017126 |
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