(Z)-5-Benzene­carbothioyl-1,11-dimethyl-6-phenyl-5H-dibenzo[d,f][1,3]diazepine

The seven-membered ring in the title compound, C(28)H(22)N(2)S, has a two-coordinate N atom as well as a three-coordinate N atom. The ring adopts a boat-shaped conformation with two C atoms of one methyl­phenyl ring as the stern and the three-coordinate N atom as the prow. The N,N-dimethyl­ethane­th...

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Detalles Bibliográficos
Autores principales: Zhang, Jia-Xin, Ng, Seik Weng
Formato: Texto
Lenguaje:English
Publicado: International Union of Crystallography 2011
Materias:
Organic Papers
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3051548/
https://www.ncbi.nlm.nih.gov/pubmed/21523042
http://dx.doi.org/10.1107/S1600536811000092
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author Zhang, Jia-Xin
Ng, Seik Weng
author_facet Zhang, Jia-Xin
Ng, Seik Weng
author_sort Zhang, Jia-Xin
collection PubMed
description The seven-membered ring in the title compound, C(28)H(22)N(2)S, has a two-coordinate N atom as well as a three-coordinate N atom. The ring adopts a boat-shaped conformation with two C atoms of one methyl­phenyl ring as the stern and the three-coordinate N atom as the prow. The N,N-dimethyl­ethane­thio­amide fragment is nearly planar (r.m.s. deviation = 0.049 Å); the phenyl ring of the benzene­carbothioyl unit connected to the three-coordinate N atom is aligned at 83.72 (4)° with respect to the mean plane of this fragment. Weak inter­molecular C—H⋯S hydrogen bonding is present in the crystal structure.
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spelling pubmed-30515482011-04-26 (Z)-5-Benzene­carbothioyl-1,11-dimethyl-6-phenyl-5H-dibenzo[d,f][1,3]diazepine Zhang, Jia-Xin Ng, Seik Weng Acta Crystallogr Sect E Struct Rep Online Organic Papers The seven-membered ring in the title compound, C(28)H(22)N(2)S, has a two-coordinate N atom as well as a three-coordinate N atom. The ring adopts a boat-shaped conformation with two C atoms of one methyl­phenyl ring as the stern and the three-coordinate N atom as the prow. The N,N-dimethyl­ethane­thio­amide fragment is nearly planar (r.m.s. deviation = 0.049 Å); the phenyl ring of the benzene­carbothioyl unit connected to the three-coordinate N atom is aligned at 83.72 (4)° with respect to the mean plane of this fragment. Weak inter­molecular C—H⋯S hydrogen bonding is present in the crystal structure. International Union of Crystallography 2011-01-12 /pmc/articles/PMC3051548/ /pubmed/21523042 http://dx.doi.org/10.1107/S1600536811000092 Text en © Zhang and Ng 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
Zhang, Jia-Xin
Ng, Seik Weng
(Z)-5-Benzene­carbothioyl-1,11-dimethyl-6-phenyl-5H-dibenzo[d,f][1,3]diazepine
title (Z)-5-Benzene­carbothioyl-1,11-dimethyl-6-phenyl-5H-dibenzo[d,f][1,3]diazepine
title_full (Z)-5-Benzene­carbothioyl-1,11-dimethyl-6-phenyl-5H-dibenzo[d,f][1,3]diazepine
title_fullStr (Z)-5-Benzene­carbothioyl-1,11-dimethyl-6-phenyl-5H-dibenzo[d,f][1,3]diazepine
title_full_unstemmed (Z)-5-Benzene­carbothioyl-1,11-dimethyl-6-phenyl-5H-dibenzo[d,f][1,3]diazepine
title_short (Z)-5-Benzene­carbothioyl-1,11-dimethyl-6-phenyl-5H-dibenzo[d,f][1,3]diazepine
title_sort (z)-5-benzene­carbothioyl-1,11-dimethyl-6-phenyl-5h-dibenzo[d,f][1,3]diazepine
topic Organic Papers
url https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3051548/
https://www.ncbi.nlm.nih.gov/pubmed/21523042
http://dx.doi.org/10.1107/S1600536811000092
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