Crystal structure of 3-benzyl­sulfanyl-6-(5-methyl-1,2-oxazol-3-yl)-1,2,4-triazolo[3,4-b][1,3,4]thia­diazole

In the title compound, C(14)H(11)N(5)OS(2), the triazolo–thia­diazole system is essentially planar (r.m.s. deviation = 0.002 Å) and makes dihedral angles of 6.33 (12) and 42.95 (14)° with the planes of the oxazole and phenyl rings, respectively. In the crystal, face-to-face π–π inter­actions are obs...

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Detalles Bibliográficos
Autores principales: Vaarla, Krishnaiah, Rao, V. Rajeswar, Akkurt, Mehmet
Formato: Online Artículo Texto
Lenguaje:English
Publicado: International Union of Crystallography 2015
Materias:
Data Reports
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC4645033/
https://www.ncbi.nlm.nih.gov/pubmed/26594538
http://dx.doi.org/10.1107/S2056989015017351
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author Vaarla, Krishnaiah
Rao, V. Rajeswar
Akkurt, Mehmet
author_facet Vaarla, Krishnaiah
Rao, V. Rajeswar
Akkurt, Mehmet
author_sort Vaarla, Krishnaiah
collection PubMed
description In the title compound, C(14)H(11)N(5)OS(2), the triazolo–thia­diazole system is essentially planar (r.m.s. deviation = 0.002 Å) and makes dihedral angles of 6.33 (12) and 42.95 (14)° with the planes of the oxazole and phenyl rings, respectively. In the crystal, face-to-face π–π inter­actions are observed between the thia­diazole and oxazole rings [centroid–centroid distance = 3.4707 (18) Å], leading to columns along [010].
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spelling pubmed-46450332015-11-20 Crystal structure of 3-benzyl­sulfanyl-6-(5-methyl-1,2-oxazol-3-yl)-1,2,4-triazolo[3,4-b][1,3,4]thia­diazole Vaarla, Krishnaiah Rao, V. Rajeswar Akkurt, Mehmet Acta Crystallogr E Crystallogr Commun Data Reports In the title compound, C(14)H(11)N(5)OS(2), the triazolo–thia­diazole system is essentially planar (r.m.s. deviation = 0.002 Å) and makes dihedral angles of 6.33 (12) and 42.95 (14)° with the planes of the oxazole and phenyl rings, respectively. In the crystal, face-to-face π–π inter­actions are observed between the thia­diazole and oxazole rings [centroid–centroid distance = 3.4707 (18) Å], leading to columns along [010]. International Union of Crystallography 2015-10-03 /pmc/articles/PMC4645033/ /pubmed/26594538 http://dx.doi.org/10.1107/S2056989015017351 Text en © Vaarla et al. 2015 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 Data Reports
Vaarla, Krishnaiah
Rao, V. Rajeswar
Akkurt, Mehmet
Crystal structure of 3-benzyl­sulfanyl-6-(5-methyl-1,2-oxazol-3-yl)-1,2,4-triazolo[3,4-b][1,3,4]thia­diazole
title Crystal structure of 3-benzyl­sulfanyl-6-(5-methyl-1,2-oxazol-3-yl)-1,2,4-triazolo[3,4-b][1,3,4]thia­diazole
title_full Crystal structure of 3-benzyl­sulfanyl-6-(5-methyl-1,2-oxazol-3-yl)-1,2,4-triazolo[3,4-b][1,3,4]thia­diazole
title_fullStr Crystal structure of 3-benzyl­sulfanyl-6-(5-methyl-1,2-oxazol-3-yl)-1,2,4-triazolo[3,4-b][1,3,4]thia­diazole
title_full_unstemmed Crystal structure of 3-benzyl­sulfanyl-6-(5-methyl-1,2-oxazol-3-yl)-1,2,4-triazolo[3,4-b][1,3,4]thia­diazole
title_short Crystal structure of 3-benzyl­sulfanyl-6-(5-methyl-1,2-oxazol-3-yl)-1,2,4-triazolo[3,4-b][1,3,4]thia­diazole
title_sort crystal structure of 3-benzyl­sulfanyl-6-(5-methyl-1,2-oxazol-3-yl)-1,2,4-triazolo[3,4-b][1,3,4]thia­diazole
topic Data Reports
url https://www.ncbi.nlm.nih.gov/pmc/articles/PMC4645033/
https://www.ncbi.nlm.nih.gov/pubmed/26594538
http://dx.doi.org/10.1107/S2056989015017351
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