(Z)-5-Benzenecarbothioyl-1,11-dimethyl-6-phenyl-5H-dibenzo[d,f][1,3]diazepine
The sevenmembered ring in the title compound, C28H 22N2S, has a twocoordinate N atom as well as a threecoordinate N atom. The ring adopts a boatshaped conformation with two C atoms of one methylphenyl ring as the stern and the threecoordinate N atom as the prow. The N,N-dimethylethanethioamide fragm...
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| Format: | Article |
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International Union of Crystallography
2011
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| _version_ | 1825721979401928704 |
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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 | UM |
| description | The sevenmembered ring in the title compound, C28H 22N2S, has a twocoordinate N atom as well as a threecoordinate N atom. The ring adopts a boatshaped conformation with two C atoms of one methylphenyl ring as the stern and the threecoordinate 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 threecoordinate 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. |
| first_indexed | 2024-03-06T05:58:37Z |
| format | Article |
| id | um.eprints-23000 |
| institution | Universiti Malaya |
| last_indexed | 2024-03-06T05:58:37Z |
| publishDate | 2011 |
| publisher | International Union of Crystallography |
| record_format | dspace |
| spelling | um.eprints-230002019-11-14T07:12:24Z http://eprints.um.edu.my/23000/ (Z)-5-Benzenecarbothioyl-1,11-dimethyl-6-phenyl-5H-dibenzo[d,f][1,3]diazepine Zhang, Jia-Xin Ng, Seik Weng Q Science (General) QD Chemistry The sevenmembered ring in the title compound, C28H 22N2S, has a twocoordinate N atom as well as a threecoordinate N atom. The ring adopts a boatshaped conformation with two C atoms of one methylphenyl ring as the stern and the threecoordinate 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 threecoordinate 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 Article PeerReviewed Zhang, Jia-Xin and Ng, Seik Weng (2011) (Z)-5-Benzenecarbothioyl-1,11-dimethyl-6-phenyl-5H-dibenzo[d,f][1,3]diazepine. Acta Crystallographica Section E: Structure Reports Online, 67 (2). o364-o364. ISSN 1600-5368, DOI https://doi.org/10.1107/S1600536811000092 <https://doi.org/10.1107/S1600536811000092>. https://doi.org/10.1107/S1600536811000092 doi:10.1107/S1600536811000092 |
| spellingShingle | Q Science (General) QD Chemistry 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 | Q Science (General) QD Chemistry |
| work_keys_str_mv | AT zhangjiaxin z5benzenecarbothioyl111dimethyl6phenyl5hdibenzodf13diazepine AT ngseikweng z5benzenecarbothioyl111dimethyl6phenyl5hdibenzodf13diazepine |