1.
Acta Crystallogr Sect E Struct Rep Online
; 70(Pt 1): o1-2, 2014 Jan 01.
Artículo
en Inglés
| MEDLINE
| ID: mdl-24526960
RESUMEN
The asymmetric unit of the title compound, 2C15H16N6O3·C3H7NO·H2O, contains two independent ethyl 6-methyl-2-oxo-4-[4-(1H-tetra-zol-5-yl)phen-yl]-1,2,3,4-tetra-hydro-pyrim-id-ine-5-carboxyl-ate mol-ecules, in which the dihedral angles between the tetra-zole and benzene rings are 20.54â (12) and 12.13â (12)°. An intra-molecular C-Hâ¯O hydrogen bond occurs in each mol-ecule. In the crystal, N-Hâ¯O, N-Hâ¯N, O-Hâ¯O and O-Hâ¯N hydrogen bonds, as well as weak C-Hâ¯O and C-Hâ¯N hydrogen bonds, link the mol-ecules into a three-dimensional supra-molecular architecture. π-π stacking is also observed between parallel tetra-zole rings of adjacent mol-ecules, the centroid-centroid distance being 3.482â (6)â Å.