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

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

The seven-membered ring in the title compound, C28H22N2S, 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 f...

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Main Authors: Jia-Xin Zhang, Seik Weng Ng
Format: Article
Language:English
Published: International Union of Crystallography 2011-02-01
Series:Acta Crystallographica Section E
Online Access:http://scripts.iucr.org/cgi-bin/paper?S1600536811000092
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spelling doaj-d6920f434e3f4ba888c83e84e6ba819a2020-11-24T21:32:46ZengInternational Union of CrystallographyActa Crystallographica Section E1600-53682011-02-01672o364o36410.1107/S1600536811000092(Z)-5-Benzenecarbothioyl-1,11-dimethyl-6-phenyl-5H-dibenzo[d,f][1,3]diazepineJia-Xin ZhangSeik Weng NgThe seven-membered ring in the title compound, C28H22N2S, 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. http://scripts.iucr.org/cgi-bin/paper?S1600536811000092
collection DOAJ
language English
format Article
sources DOAJ
author Jia-Xin Zhang
Seik Weng Ng
spellingShingle Jia-Xin Zhang
Seik Weng Ng
(Z)-5-Benzenecarbothioyl-1,11-dimethyl-6-phenyl-5H-dibenzo[d,f][1,3]diazepine
Acta Crystallographica Section E
author_facet Jia-Xin Zhang
Seik Weng Ng
author_sort Jia-Xin Zhang
title (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_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_sort (z)-5-benzenecarbothioyl-1,11-dimethyl-6-phenyl-5h-dibenzo[d,f][1,3]diazepine
publisher International Union of Crystallography
series Acta Crystallographica Section E
issn 1600-5368
publishDate 2011-02-01
description The seven-membered ring in the title compound, C28H22N2S, 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.
url http://scripts.iucr.org/cgi-bin/paper?S1600536811000092
work_keys_str_mv AT jiaxinzhang z5benzenecarbothioyl111dimethyl6phenyl5hdibenzodf13diazepine
AT seikwengng z5benzenecarbothioyl111dimethyl6phenyl5hdibenzodf13diazepine
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