Ontology highlight
ABSTRACT:
SUBMITTER: Rivera A
PROVIDER: S-EPMC5120723 | biostudies-literature | 2016 Sep
REPOSITORIES: biostudies-literature
Acta crystallographica. Section E, Crystallographic communications 20160831 Pt 9
In the title hydrate, C<sub>28</sub>H<sub>42</sub>N<sub>2</sub>O<sub>3</sub>·H<sub>2</sub>O, the central 1,3-diazinan-5-ol ring adopts a chair conformation with the two benzyl substituents equatorial and the lone pairs of the N atoms axial. The dihedral angle between the aromatic rings is 19.68 (38)°. There are two intra-molecular O-H⋯N hydrogen bonds, each generating an <i>S</i>(6) ring motif. In the crystal, classical O-H⋯O hydrogen bonds connect the 1,3-diazinane and water mol-ecules into col ...[more]