3-[3-Methyl-4-(4-nitro­benzyl­idene­amino)-5-sulfanyl­idene-4,5-dihydro-1H-1,2,4-triazol-1-yl]-1,3-diphenyl­propan-1-one dichloro­methane monosolvate

In the title compound, C(25)H(21)N(5)O(3)S·CH(2)Cl(2), the dichloro­methane solvent mol­ecule is disordered over four positions, with an occupancy ratio of 0.271 (3):0.3884 (18):0.298 (2):0.0424 (15). The 1,2,4-triazole ring makes dihedral angles of 47.3 (2)/87.3 (2) and 3.6 (2)° with the phenyl and...

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Autores principales: Wang, Wei, Jia, Wei-Min, Xu, Chao, Wu, Wen-Peng, Liu, Qing-Lei
Formato: Online Artículo Texto
Lenguaje:English
Publicado: International Union of Crystallography 2011
Materias:
Organic Papers
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3247519/
https://www.ncbi.nlm.nih.gov/pubmed/22220137
http://dx.doi.org/10.1107/S1600536811043777
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author Wang, Wei
Jia, Wei-Min
Xu, Chao
Wu, Wen-Peng
Liu, Qing-Lei
author_facet Wang, Wei
Jia, Wei-Min
Xu, Chao
Wu, Wen-Peng
Liu, Qing-Lei
author_sort Wang, Wei
collection PubMed
description In the title compound, C(25)H(21)N(5)O(3)S·CH(2)Cl(2), the dichloro­methane solvent mol­ecule is disordered over four positions, with an occupancy ratio of 0.271 (3):0.3884 (18):0.298 (2):0.0424 (15). The 1,2,4-triazole ring makes dihedral angles of 47.3 (2)/87.3 (2) and 3.6 (2)° with the phenyl and nitro­phenyl rings, respectively. An intra­molecular C—H⋯S hydrogen bond results in the formation of an almost planar six-membered ring [r.m.s. derivation = 0.0051 (2) Å]. Inter­molecular C—H⋯O hydrogen bonding consolidates the structure.
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spelling pubmed-32475192012-01-04 3-[3-Methyl-4-(4-nitro­benzyl­idene­amino)-5-sulfanyl­idene-4,5-dihydro-1H-1,2,4-triazol-1-yl]-1,3-diphenyl­propan-1-one dichloro­methane monosolvate Wang, Wei Jia, Wei-Min Xu, Chao Wu, Wen-Peng Liu, Qing-Lei Acta Crystallogr Sect E Struct Rep Online Organic Papers In the title compound, C(25)H(21)N(5)O(3)S·CH(2)Cl(2), the dichloro­methane solvent mol­ecule is disordered over four positions, with an occupancy ratio of 0.271 (3):0.3884 (18):0.298 (2):0.0424 (15). The 1,2,4-triazole ring makes dihedral angles of 47.3 (2)/87.3 (2) and 3.6 (2)° with the phenyl and nitro­phenyl rings, respectively. An intra­molecular C—H⋯S hydrogen bond results in the formation of an almost planar six-membered ring [r.m.s. derivation = 0.0051 (2) Å]. Inter­molecular C—H⋯O hydrogen bonding consolidates the structure. International Union of Crystallography 2011-10-29 /pmc/articles/PMC3247519/ /pubmed/22220137 http://dx.doi.org/10.1107/S1600536811043777 Text en © Wang 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
Wang, Wei
Jia, Wei-Min
Xu, Chao
Wu, Wen-Peng
Liu, Qing-Lei
3-[3-Methyl-4-(4-nitro­benzyl­idene­amino)-5-sulfanyl­idene-4,5-dihydro-1H-1,2,4-triazol-1-yl]-1,3-diphenyl­propan-1-one dichloro­methane monosolvate
title 3-[3-Methyl-4-(4-nitro­benzyl­idene­amino)-5-sulfanyl­idene-4,5-dihydro-1H-1,2,4-triazol-1-yl]-1,3-diphenyl­propan-1-one dichloro­methane monosolvate
title_full 3-[3-Methyl-4-(4-nitro­benzyl­idene­amino)-5-sulfanyl­idene-4,5-dihydro-1H-1,2,4-triazol-1-yl]-1,3-diphenyl­propan-1-one dichloro­methane monosolvate
title_fullStr 3-[3-Methyl-4-(4-nitro­benzyl­idene­amino)-5-sulfanyl­idene-4,5-dihydro-1H-1,2,4-triazol-1-yl]-1,3-diphenyl­propan-1-one dichloro­methane monosolvate
title_full_unstemmed 3-[3-Methyl-4-(4-nitro­benzyl­idene­amino)-5-sulfanyl­idene-4,5-dihydro-1H-1,2,4-triazol-1-yl]-1,3-diphenyl­propan-1-one dichloro­methane monosolvate
title_short 3-[3-Methyl-4-(4-nitro­benzyl­idene­amino)-5-sulfanyl­idene-4,5-dihydro-1H-1,2,4-triazol-1-yl]-1,3-diphenyl­propan-1-one dichloro­methane monosolvate
title_sort 3-[3-methyl-4-(4-nitro­benzyl­idene­amino)-5-sulfanyl­idene-4,5-dihydro-1h-1,2,4-triazol-1-yl]-1,3-diphenyl­propan-1-one dichloro­methane monosolvate
topic Organic Papers
url https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3247519/
https://www.ncbi.nlm.nih.gov/pubmed/22220137
http://dx.doi.org/10.1107/S1600536811043777
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