( E )-2-Phenyl-4-styryl-2,3-dihydro-1 H -1,5-benzodiazepine hemihydrate
The unit cell contains eight molecules of the title compound, with half a water molecule per main molecule, C 23 H 20 N 2 ·0.5H 2 O. The seven-membered diazepine ring adopts a twist-boat conformation and makes dihedral angles of 85.08 (7) and 32.79 (7)° with the phenyl and styryl substituents, respe...
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Published in | IUCrData Vol. 2; no. 7 |
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Main Authors | , , , |
Format | Journal Article |
Language | English |
Published |
28.07.2017
|
Online Access | Get full text |
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Summary: | The unit cell contains eight molecules of the title compound, with half a water molecule per main molecule, C
23
H
20
N
2
·0.5H
2
O. The seven-membered diazepine ring adopts a twist-boat conformation and makes dihedral angles of 85.08 (7) and 32.79 (7)° with the phenyl and styryl substituents, respectively. In the crystal, the organic molecules are linked by C—H...N hydrogen bonds into chains running along the
b-
axis direction. The water molecule, located on a twofold rotation axis, forms hydrogen bridges, connecting two adjacent chains. |
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ISSN: | 2414-3146 2414-3146 |
DOI: | 10.1107/S2414314617010707 |