5,5′-[1,4-Phenyl­enebis(methyl­enesulfanedi­yl)]bis­[1,3,4-thia­diazol-2(3H)-one] dimethyl sulfoxide disolvate

The asymmetric unit of the title compound, C(12)H(10)N(4)O(2)S(4)·2C(2)H(6)OS, contains one half of the p-xylene mol­ecule and one dimethyl sulfoxide mol­ecule. The p-xylene mol­ecule is located about a crystallographic inversion centre. In the mol­ecule, the thia­diazole and benzene rings are almos...

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Detalles Bibliográficos
Autores principales: Kang, Sung Kwon, Cho, Nam Sook, Jang, Siyoung
Formato: Online Artículo Texto
Lenguaje:English
Publicado: International Union of Crystallography 2012
Materias:
Organic Papers
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3297851/
https://www.ncbi.nlm.nih.gov/pubmed/22412654
http://dx.doi.org/10.1107/S1600536812006289
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author Kang, Sung Kwon
Cho, Nam Sook
Jang, Siyoung
author_facet Kang, Sung Kwon
Cho, Nam Sook
Jang, Siyoung
author_sort Kang, Sung Kwon
collection PubMed
description The asymmetric unit of the title compound, C(12)H(10)N(4)O(2)S(4)·2C(2)H(6)OS, contains one half of the p-xylene mol­ecule and one dimethyl sulfoxide mol­ecule. The p-xylene mol­ecule is located about a crystallographic inversion centre. In the mol­ecule, the thia­diazole and benzene rings are almost perpendicular to one another, with a dihedral angle of 88.95 (6)°. In the crystal, an N—H⋯O hydrogen bond is observed between the two components. The dimethyl sulfoxide mol­ecule is disordered over two orientations with an occupancy ratio of 0.879 (1):0.121 (1).
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spelling pubmed-32978512012-03-12 5,5′-[1,4-Phenyl­enebis(methyl­enesulfanedi­yl)]bis­[1,3,4-thia­diazol-2(3H)-one] dimethyl sulfoxide disolvate Kang, Sung Kwon Cho, Nam Sook Jang, Siyoung Acta Crystallogr Sect E Struct Rep Online Organic Papers The asymmetric unit of the title compound, C(12)H(10)N(4)O(2)S(4)·2C(2)H(6)OS, contains one half of the p-xylene mol­ecule and one dimethyl sulfoxide mol­ecule. The p-xylene mol­ecule is located about a crystallographic inversion centre. In the mol­ecule, the thia­diazole and benzene rings are almost perpendicular to one another, with a dihedral angle of 88.95 (6)°. In the crystal, an N—H⋯O hydrogen bond is observed between the two components. The dimethyl sulfoxide mol­ecule is disordered over two orientations with an occupancy ratio of 0.879 (1):0.121 (1). International Union of Crystallography 2012-02-17 /pmc/articles/PMC3297851/ /pubmed/22412654 http://dx.doi.org/10.1107/S1600536812006289 Text en © Kang 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
Kang, Sung Kwon
Cho, Nam Sook
Jang, Siyoung
5,5′-[1,4-Phenyl­enebis(methyl­enesulfanedi­yl)]bis­[1,3,4-thia­diazol-2(3H)-one] dimethyl sulfoxide disolvate
title 5,5′-[1,4-Phenyl­enebis(methyl­enesulfanedi­yl)]bis­[1,3,4-thia­diazol-2(3H)-one] dimethyl sulfoxide disolvate
title_full 5,5′-[1,4-Phenyl­enebis(methyl­enesulfanedi­yl)]bis­[1,3,4-thia­diazol-2(3H)-one] dimethyl sulfoxide disolvate
title_fullStr 5,5′-[1,4-Phenyl­enebis(methyl­enesulfanedi­yl)]bis­[1,3,4-thia­diazol-2(3H)-one] dimethyl sulfoxide disolvate
title_full_unstemmed 5,5′-[1,4-Phenyl­enebis(methyl­enesulfanedi­yl)]bis­[1,3,4-thia­diazol-2(3H)-one] dimethyl sulfoxide disolvate
title_short 5,5′-[1,4-Phenyl­enebis(methyl­enesulfanedi­yl)]bis­[1,3,4-thia­diazol-2(3H)-one] dimethyl sulfoxide disolvate
title_sort 5,5′-[1,4-phenyl­enebis(methyl­enesulfanedi­yl)]bis­[1,3,4-thia­diazol-2(3h)-one] dimethyl sulfoxide disolvate
topic Organic Papers
url https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3297851/
https://www.ncbi.nlm.nih.gov/pubmed/22412654
http://dx.doi.org/10.1107/S1600536812006289
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AT jangsiyoung 5514phenylenebismethylenesulfanediylbis134thiadiazol23honedimethylsulfoxidedisolvate

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