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3-Chloro-4-[2-(4-chlorobenzylidene)hydrazinylidene]-1-methyl-3,4-dihydro-1H-2λ(6),1-benzothiazine-2,2-dione
In the title compound, C(16)H(13)Cl(2)N(3)O(2)S, the dihedral angle between the aromatic rings is 6.62 (2)° and the C=N—N=C torsion angle is 176.2 (4)°. The thiazine ring shows an envelope conformation, with the S atom displaced by 0.633 (6) Å from the mean plane of the other five atoms (r.m.s. dev...
Autores principales: | , , , , |
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Formato: | Online Artículo Texto |
Lenguaje: | English |
Publicado: |
International Union of Crystallography
2013
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Materias: | |
Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3588526/ https://www.ncbi.nlm.nih.gov/pubmed/23476596 http://dx.doi.org/10.1107/S1600536813004443 |
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author | Ahmad, Saeed Shafiq, Muhammad Tahir, M. Nawaz Harrison, William T. A. Khan, Islam Ullah |
author_facet | Ahmad, Saeed Shafiq, Muhammad Tahir, M. Nawaz Harrison, William T. A. Khan, Islam Ullah |
author_sort | Ahmad, Saeed |
collection | PubMed |
description | In the title compound, C(16)H(13)Cl(2)N(3)O(2)S, the dihedral angle between the aromatic rings is 6.62 (2)° and the C=N—N=C torsion angle is 176.2 (4)°. The thiazine ring shows an envelope conformation, with the S atom displaced by 0.633 (6) Å from the mean plane of the other five atoms (r.m.s. deviation = 0.037 Å). The Cl atom is an an axial conformation and is displaced by 2.015 (6) Å from the thiazine ring plane. In the crystal, molecules are linked by C—H⋯O interactions, generating a three-dimensional network. Very weak aromatic π–π stacking interactions [centroid–centroid separations = 3.928 (2) Å] are also observed. |
format | Online Article Text |
id | pubmed-3588526 |
institution | National Center for Biotechnology Information |
language | English |
publishDate | 2013 |
publisher | International Union of Crystallography |
record_format | MEDLINE/PubMed |
spelling | pubmed-35885262013-03-08 3-Chloro-4-[2-(4-chlorobenzylidene)hydrazinylidene]-1-methyl-3,4-dihydro-1H-2λ(6),1-benzothiazine-2,2-dione Ahmad, Saeed Shafiq, Muhammad Tahir, M. Nawaz Harrison, William T. A. Khan, Islam Ullah Acta Crystallogr Sect E Struct Rep Online Organic Papers In the title compound, C(16)H(13)Cl(2)N(3)O(2)S, the dihedral angle between the aromatic rings is 6.62 (2)° and the C=N—N=C torsion angle is 176.2 (4)°. The thiazine ring shows an envelope conformation, with the S atom displaced by 0.633 (6) Å from the mean plane of the other five atoms (r.m.s. deviation = 0.037 Å). The Cl atom is an an axial conformation and is displaced by 2.015 (6) Å from the thiazine ring plane. In the crystal, molecules are linked by C—H⋯O interactions, generating a three-dimensional network. Very weak aromatic π–π stacking interactions [centroid–centroid separations = 3.928 (2) Å] are also observed. International Union of Crystallography 2013-02-23 /pmc/articles/PMC3588526/ /pubmed/23476596 http://dx.doi.org/10.1107/S1600536813004443 Text en © Ahmad et al. 2013 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 Ahmad, Saeed Shafiq, Muhammad Tahir, M. Nawaz Harrison, William T. A. Khan, Islam Ullah 3-Chloro-4-[2-(4-chlorobenzylidene)hydrazinylidene]-1-methyl-3,4-dihydro-1H-2λ(6),1-benzothiazine-2,2-dione |
title | 3-Chloro-4-[2-(4-chlorobenzylidene)hydrazinylidene]-1-methyl-3,4-dihydro-1H-2λ(6),1-benzothiazine-2,2-dione |
title_full | 3-Chloro-4-[2-(4-chlorobenzylidene)hydrazinylidene]-1-methyl-3,4-dihydro-1H-2λ(6),1-benzothiazine-2,2-dione |
title_fullStr | 3-Chloro-4-[2-(4-chlorobenzylidene)hydrazinylidene]-1-methyl-3,4-dihydro-1H-2λ(6),1-benzothiazine-2,2-dione |
title_full_unstemmed | 3-Chloro-4-[2-(4-chlorobenzylidene)hydrazinylidene]-1-methyl-3,4-dihydro-1H-2λ(6),1-benzothiazine-2,2-dione |
title_short | 3-Chloro-4-[2-(4-chlorobenzylidene)hydrazinylidene]-1-methyl-3,4-dihydro-1H-2λ(6),1-benzothiazine-2,2-dione |
title_sort | 3-chloro-4-[2-(4-chlorobenzylidene)hydrazinylidene]-1-methyl-3,4-dihydro-1h-2λ(6),1-benzothiazine-2,2-dione |
topic | Organic Papers |
url | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3588526/ https://www.ncbi.nlm.nih.gov/pubmed/23476596 http://dx.doi.org/10.1107/S1600536813004443 |
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