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6-(4-Fluoro­phen­yl)-3-phenyl-7H-1,2,4-tri­azolo[3,4-b][1,3,4]thia­diazine

In the title compound, C(16)H(11)FN(4)S, the dihedral angles between the triazole ring and the phenyl and fluoro­benzene rings are 23.22 (17) and 18.06 (17)°, respectively. The six-membered heterocyclic ring adopts a distorted envelope conformation, with the methyl­ene C atom as the flap. In the cry...

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Autores principales: Palakshamurthy, B. S., Devarajegowda, H. C., Mohan, N. R., Sreenivasa, S., Suchetan, P. A.
Formato: Online Artículo Texto
Lenguaje:English
Publicado: International Union of Crystallography 2014
Materias:
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3998453/
https://www.ncbi.nlm.nih.gov/pubmed/24765056
http://dx.doi.org/10.1107/S1600536814003262
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author Palakshamurthy, B. S.
Devarajegowda, H. C.
Mohan, N. R.
Sreenivasa, S.
Suchetan, P. A.
author_facet Palakshamurthy, B. S.
Devarajegowda, H. C.
Mohan, N. R.
Sreenivasa, S.
Suchetan, P. A.
author_sort Palakshamurthy, B. S.
collection PubMed
description In the title compound, C(16)H(11)FN(4)S, the dihedral angles between the triazole ring and the phenyl and fluoro­benzene rings are 23.22 (17) and 18.06 (17)°, respectively. The six-membered heterocyclic ring adopts a distorted envelope conformation, with the methyl­ene C atom as the flap. In the crystal, the mol­ecules are linked by two C—H⋯N and C—H⋯F inter­actions along [010], forming C(5), C(8) and C(13) chains repectively. C—H⋯π inter­actions involving the phenyl ring and π–π inter­actions [centroid–centroid separation for triazole rings = 3.5660 (18) Å] are also observed.
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spelling pubmed-39984532014-04-24 6-(4-Fluoro­phen­yl)-3-phenyl-7H-1,2,4-tri­azolo[3,4-b][1,3,4]thia­diazine Palakshamurthy, B. S. Devarajegowda, H. C. Mohan, N. R. Sreenivasa, S. Suchetan, P. A. Acta Crystallogr Sect E Struct Rep Online Organic Papers In the title compound, C(16)H(11)FN(4)S, the dihedral angles between the triazole ring and the phenyl and fluoro­benzene rings are 23.22 (17) and 18.06 (17)°, respectively. The six-membered heterocyclic ring adopts a distorted envelope conformation, with the methyl­ene C atom as the flap. In the crystal, the mol­ecules are linked by two C—H⋯N and C—H⋯F inter­actions along [010], forming C(5), C(8) and C(13) chains repectively. C—H⋯π inter­actions involving the phenyl ring and π–π inter­actions [centroid–centroid separation for triazole rings = 3.5660 (18) Å] are also observed. International Union of Crystallography 2014-02-28 /pmc/articles/PMC3998453/ /pubmed/24765056 http://dx.doi.org/10.1107/S1600536814003262 Text en © Palakshamurthy et al. 2014 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
Palakshamurthy, B. S.
Devarajegowda, H. C.
Mohan, N. R.
Sreenivasa, S.
Suchetan, P. A.
6-(4-Fluoro­phen­yl)-3-phenyl-7H-1,2,4-tri­azolo[3,4-b][1,3,4]thia­diazine
title 6-(4-Fluoro­phen­yl)-3-phenyl-7H-1,2,4-tri­azolo[3,4-b][1,3,4]thia­diazine
title_full 6-(4-Fluoro­phen­yl)-3-phenyl-7H-1,2,4-tri­azolo[3,4-b][1,3,4]thia­diazine
title_fullStr 6-(4-Fluoro­phen­yl)-3-phenyl-7H-1,2,4-tri­azolo[3,4-b][1,3,4]thia­diazine
title_full_unstemmed 6-(4-Fluoro­phen­yl)-3-phenyl-7H-1,2,4-tri­azolo[3,4-b][1,3,4]thia­diazine
title_short 6-(4-Fluoro­phen­yl)-3-phenyl-7H-1,2,4-tri­azolo[3,4-b][1,3,4]thia­diazine
title_sort 6-(4-fluoro­phen­yl)-3-phenyl-7h-1,2,4-tri­azolo[3,4-b][1,3,4]thia­diazine
topic Organic Papers
url https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3998453/
https://www.ncbi.nlm.nih.gov/pubmed/24765056
http://dx.doi.org/10.1107/S1600536814003262
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