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1-Ethyl-1H-2,1-benzothiazin-4(3H)-one 2,2-dioxide
In the title compound, C(10)H(11)NO(3)S, there is distorted tetrahedral geometry around the S atom. The heterocyclic thiazine ring adopts a half-chair conformation. The ethyl and sulfonyl groups form dihedral angles of 82.53 (13) and 88.91 (9)°, respectively, with the plane formed by the benzothia...
Autores principales: | , , , |
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Formato: | Texto |
Lenguaje: | English |
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International Union of Crystallography
2008
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Materias: | |
Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC2960787/ https://www.ncbi.nlm.nih.gov/pubmed/21201901 http://dx.doi.org/10.1107/S1600536808003504 |
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author | Shafiq, Muhammad Khan, Islam Ullah Tahir, M. Nawaz Siddiqui, Waseeq Ahmad |
author_facet | Shafiq, Muhammad Khan, Islam Ullah Tahir, M. Nawaz Siddiqui, Waseeq Ahmad |
author_sort | Shafiq, Muhammad |
collection | PubMed |
description | In the title compound, C(10)H(11)NO(3)S, there is distorted tetrahedral geometry around the S atom. The heterocyclic thiazine ring adopts a half-chair conformation. The ethyl and sulfonyl groups form dihedral angles of 82.53 (13) and 88.91 (9)°, respectively, with the plane formed by the benzothiazine ring, excluding the S atom; the S atom and the ethyl group lie on opposite sides of the ring. The molecules are linked into dimers by intermolecular C—H⋯O hydrogen bonds involving benzene C—H and carbonyl O atoms, thus forming eight-membered rings. The dimers are linked into chains via interactions of a similar type. There is an intramolecular C—H⋯O hydrogen bond. |
format | Text |
id | pubmed-2960787 |
institution | National Center for Biotechnology Information |
language | English |
publishDate | 2008 |
publisher | International Union of Crystallography |
record_format | MEDLINE/PubMed |
spelling | pubmed-29607872010-12-30 1-Ethyl-1H-2,1-benzothiazin-4(3H)-one 2,2-dioxide Shafiq, Muhammad Khan, Islam Ullah Tahir, M. Nawaz Siddiqui, Waseeq Ahmad Acta Crystallogr Sect E Struct Rep Online Organic Papers In the title compound, C(10)H(11)NO(3)S, there is distorted tetrahedral geometry around the S atom. The heterocyclic thiazine ring adopts a half-chair conformation. The ethyl and sulfonyl groups form dihedral angles of 82.53 (13) and 88.91 (9)°, respectively, with the plane formed by the benzothiazine ring, excluding the S atom; the S atom and the ethyl group lie on opposite sides of the ring. The molecules are linked into dimers by intermolecular C—H⋯O hydrogen bonds involving benzene C—H and carbonyl O atoms, thus forming eight-membered rings. The dimers are linked into chains via interactions of a similar type. There is an intramolecular C—H⋯O hydrogen bond. International Union of Crystallography 2008-02-06 /pmc/articles/PMC2960787/ /pubmed/21201901 http://dx.doi.org/10.1107/S1600536808003504 Text en © Shafiq et al. 2008 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 Shafiq, Muhammad Khan, Islam Ullah Tahir, M. Nawaz Siddiqui, Waseeq Ahmad 1-Ethyl-1H-2,1-benzothiazin-4(3H)-one 2,2-dioxide |
title | 1-Ethyl-1H-2,1-benzothiazin-4(3H)-one 2,2-dioxide |
title_full | 1-Ethyl-1H-2,1-benzothiazin-4(3H)-one 2,2-dioxide |
title_fullStr | 1-Ethyl-1H-2,1-benzothiazin-4(3H)-one 2,2-dioxide |
title_full_unstemmed | 1-Ethyl-1H-2,1-benzothiazin-4(3H)-one 2,2-dioxide |
title_short | 1-Ethyl-1H-2,1-benzothiazin-4(3H)-one 2,2-dioxide |
title_sort | 1-ethyl-1h-2,1-benzothiazin-4(3h)-one 2,2-dioxide |
topic | Organic Papers |
url | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC2960787/ https://www.ncbi.nlm.nih.gov/pubmed/21201901 http://dx.doi.org/10.1107/S1600536808003504 |
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