R. D. Shah, M. Jotani, J. Jasinski
Feb 13, 2010
Citations
0
Influential Citations
1
Citations
Journal
Acta Crystallographica Section E: Structure Reports Online
Abstract
In the title compound, C18H11ClN6, the pyrrole, pyrimidine and tetrazole rings form a nearly planar fused trihetrocyclic system with an r.m.s. deviation of 0.0387 (13) Å, to which the 4-chlorophenyl group and the phenyl group are substituted at the 7 and 9 positions, respectively. The dihedral angles between the pyrrole ring and the 4-chlorophenyl and phenyl rings are 32.1 (4) and 7.87 (7)°, respectively. In the crystal, weak intermolecular C—H⋯N and C—H⋯Cl hydrogen bonds link the molecules into a layer parallel to the (001) plane. The layers are further connected by π–π stacking interactions [centroid–centroid distances: 3.8413 (8) and 3.5352 (8) Å]. Intramolecular C—H⋯N hydrogen bonds are also present.