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2-(6-Phenyl-7H-1,2,4-triazolo[3,4-b][1,3,4]thiadiazin-3-yl)-1,3-benzothiazole
In the title compound, C(17)H(11)N(5)S(2), the dihedral angles formed between the triazole ring and the benzene ring and the 1,3-benzothiazole ring system are 8.67 (8) and 13.90 (9)°, respectively. The conformation of the triazolo-thiadiazin-3-yl fused ring system is a twisted half-chair. Overall,...
Autores principales: | , , |
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Formato: | Online Artículo Texto |
Lenguaje: | English |
Publicado: |
International Union of Crystallography
2011
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Materias: | |
Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3201480/ https://www.ncbi.nlm.nih.gov/pubmed/22058756 http://dx.doi.org/10.1107/S1600536811036452 |
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author | Abdel-Aziz, Hatem A. Ng, Seik Weng Tiekink, Edward R. T. |
author_facet | Abdel-Aziz, Hatem A. Ng, Seik Weng Tiekink, Edward R. T. |
author_sort | Abdel-Aziz, Hatem A. |
collection | PubMed |
description | In the title compound, C(17)H(11)N(5)S(2), the dihedral angles formed between the triazole ring and the benzene ring and the 1,3-benzothiazole ring system are 8.67 (8) and 13.90 (9)°, respectively. The conformation of the triazolo-thiadiazin-3-yl fused ring system is a twisted half-chair. Overall, the molecule adopts a flattened shape. Supramolecular helical chains along the a axis sustained by C—H⋯N interactions are found in the crystal structure. These are linked via C—H⋯π contacts as well as π–π [centroid–centroid distance = 3.5911 (12) Å] interactions between the triazole and thiazole rings. |
format | Online Article Text |
id | pubmed-3201480 |
institution | National Center for Biotechnology Information |
language | English |
publishDate | 2011 |
publisher | International Union of Crystallography |
record_format | MEDLINE/PubMed |
spelling | pubmed-32014802011-11-06 2-(6-Phenyl-7H-1,2,4-triazolo[3,4-b][1,3,4]thiadiazin-3-yl)-1,3-benzothiazole Abdel-Aziz, Hatem A. Ng, Seik Weng Tiekink, Edward R. T. Acta Crystallogr Sect E Struct Rep Online Organic Papers In the title compound, C(17)H(11)N(5)S(2), the dihedral angles formed between the triazole ring and the benzene ring and the 1,3-benzothiazole ring system are 8.67 (8) and 13.90 (9)°, respectively. The conformation of the triazolo-thiadiazin-3-yl fused ring system is a twisted half-chair. Overall, the molecule adopts a flattened shape. Supramolecular helical chains along the a axis sustained by C—H⋯N interactions are found in the crystal structure. These are linked via C—H⋯π contacts as well as π–π [centroid–centroid distance = 3.5911 (12) Å] interactions between the triazole and thiazole rings. International Union of Crystallography 2011-09-14 /pmc/articles/PMC3201480/ /pubmed/22058756 http://dx.doi.org/10.1107/S1600536811036452 Text en © Abdel-Aziz et al. 2011 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 Abdel-Aziz, Hatem A. Ng, Seik Weng Tiekink, Edward R. T. 2-(6-Phenyl-7H-1,2,4-triazolo[3,4-b][1,3,4]thiadiazin-3-yl)-1,3-benzothiazole |
title | 2-(6-Phenyl-7H-1,2,4-triazolo[3,4-b][1,3,4]thiadiazin-3-yl)-1,3-benzothiazole |
title_full | 2-(6-Phenyl-7H-1,2,4-triazolo[3,4-b][1,3,4]thiadiazin-3-yl)-1,3-benzothiazole |
title_fullStr | 2-(6-Phenyl-7H-1,2,4-triazolo[3,4-b][1,3,4]thiadiazin-3-yl)-1,3-benzothiazole |
title_full_unstemmed | 2-(6-Phenyl-7H-1,2,4-triazolo[3,4-b][1,3,4]thiadiazin-3-yl)-1,3-benzothiazole |
title_short | 2-(6-Phenyl-7H-1,2,4-triazolo[3,4-b][1,3,4]thiadiazin-3-yl)-1,3-benzothiazole |
title_sort | 2-(6-phenyl-7h-1,2,4-triazolo[3,4-b][1,3,4]thiadiazin-3-yl)-1,3-benzothiazole |
topic | Organic Papers |
url | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3201480/ https://www.ncbi.nlm.nih.gov/pubmed/22058756 http://dx.doi.org/10.1107/S1600536811036452 |
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