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rac-(3S,4Z)-3-Chloro-4-[2-(3-fluorobenzylidene)hydrazinylidene]-1-methyl-3,4-dihydro-1H-2λ(6),1-benzothiazine-2,2-dione
In the title compound, C(16)H(13)ClFN(3)O(2)S, the dihedral angle between the benzene rings is 4.47 (3)°. The conformation of the thiazine ring is a half-chair and the Cl atom is in an axial orientation. In the crystal, molecules are linked by C—H⋯F interactions, generating C(12) chains propagati...
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/PMC3379366/ https://www.ncbi.nlm.nih.gov/pubmed/22719564 http://dx.doi.org/10.1107/S1600536812021654 |
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author | Shafiq, Muhammad Tahir, M. Nawaz Khan, Islam Ullah Ahmad, Saeed |
author_facet | Shafiq, Muhammad Tahir, M. Nawaz Khan, Islam Ullah Ahmad, Saeed |
author_sort | Shafiq, Muhammad |
collection | PubMed |
description | In the title compound, C(16)H(13)ClFN(3)O(2)S, the dihedral angle between the benzene rings is 4.47 (3)°. The conformation of the thiazine ring is a half-chair and the Cl atom is in an axial orientation. In the crystal, molecules are linked by C—H⋯F interactions, generating C(12) chains propagating in [011]. Aromatic π–π stacking interactions [centroid–centroid separations = 3.753 (2) and 3.758 (2) Å] also occur. |
format | Online Article Text |
id | pubmed-3379366 |
institution | National Center for Biotechnology Information |
language | English |
publishDate | 2012 |
publisher | International Union of Crystallography |
record_format | MEDLINE/PubMed |
spelling | pubmed-33793662012-06-20 rac-(3S,4Z)-3-Chloro-4-[2-(3-fluorobenzylidene)hydrazinylidene]-1-methyl-3,4-dihydro-1H-2λ(6),1-benzothiazine-2,2-dione Shafiq, Muhammad Tahir, M. Nawaz Khan, Islam Ullah Ahmad, Saeed Acta Crystallogr Sect E Struct Rep Online Organic Papers In the title compound, C(16)H(13)ClFN(3)O(2)S, the dihedral angle between the benzene rings is 4.47 (3)°. The conformation of the thiazine ring is a half-chair and the Cl atom is in an axial orientation. In the crystal, molecules are linked by C—H⋯F interactions, generating C(12) chains propagating in [011]. Aromatic π–π stacking interactions [centroid–centroid separations = 3.753 (2) and 3.758 (2) Å] also occur. International Union of Crystallography 2012-05-19 /pmc/articles/PMC3379366/ /pubmed/22719564 http://dx.doi.org/10.1107/S1600536812021654 Text en © Shafiq 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 Shafiq, Muhammad Tahir, M. Nawaz Khan, Islam Ullah Ahmad, Saeed rac-(3S,4Z)-3-Chloro-4-[2-(3-fluorobenzylidene)hydrazinylidene]-1-methyl-3,4-dihydro-1H-2λ(6),1-benzothiazine-2,2-dione |
title |
rac-(3S,4Z)-3-Chloro-4-[2-(3-fluorobenzylidene)hydrazinylidene]-1-methyl-3,4-dihydro-1H-2λ(6),1-benzothiazine-2,2-dione |
title_full |
rac-(3S,4Z)-3-Chloro-4-[2-(3-fluorobenzylidene)hydrazinylidene]-1-methyl-3,4-dihydro-1H-2λ(6),1-benzothiazine-2,2-dione |
title_fullStr |
rac-(3S,4Z)-3-Chloro-4-[2-(3-fluorobenzylidene)hydrazinylidene]-1-methyl-3,4-dihydro-1H-2λ(6),1-benzothiazine-2,2-dione |
title_full_unstemmed |
rac-(3S,4Z)-3-Chloro-4-[2-(3-fluorobenzylidene)hydrazinylidene]-1-methyl-3,4-dihydro-1H-2λ(6),1-benzothiazine-2,2-dione |
title_short |
rac-(3S,4Z)-3-Chloro-4-[2-(3-fluorobenzylidene)hydrazinylidene]-1-methyl-3,4-dihydro-1H-2λ(6),1-benzothiazine-2,2-dione |
title_sort | rac-(3s,4z)-3-chloro-4-[2-(3-fluorobenzylidene)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/PMC3379366/ https://www.ncbi.nlm.nih.gov/pubmed/22719564 http://dx.doi.org/10.1107/S1600536812021654 |
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