The title compound, C12H18N2·0.5H2O, crystallizes with two independent organic mol-ecules (A and B) in the asymmetric unit, together with a water mol-ecule of crystallization. The diazepine rings in each mol-ecule have a chair conformation. The dihedral angle between benzene ring and the mean plane of the diazepine ring is 21.15 (12)° in mol-ecule A and 17.42 (11)° in mol-ecule B. In the crystal, mol-ecules are linked by N-H⋯O and O-H⋯N hydrogen bonds, forming zigzag chains propagating along [001].
Download full-text PDF |
Source |
|---|---|
| http://www.ncbi.nlm.nih.gov/pmc/articles/PMC4571402 | PMC |
| http://dx.doi.org/10.1107/S2056989015013201 | DOI Listing |
Publication Analysis
Top Keywords
crystal structure
4
structure 224-trimethyl-2345-tetra-hydro-1h-benzo[b][14]diazepine
4
224-trimethyl-2345-tetra-hydro-1h-benzo[b][14]diazepine hemihydrate
4
hemihydrate title
4
title compound
4
compound c12h18n2·05h2o
4
c12h18n2·05h2o crystallizes
4
crystallizes independent
4
independent organic
4
organic mol-ecules
4
Similar Publications
Want AI Summaries of new PubMed Abstracts delivered to your In-box?
Enter search terms and have AI summaries delivered each week - change queries or unsubscribe any time!