[Open access]

[Contents scheme]

Acta Cryst. (2013). E69, o414-o415
[ doi:10.1107/S1600536813004492 ]


B. F. Abdel-Wahab, H. A. Mohamed, S. W. Ng and E. R. T. Tiekink

Abstract: In the title compound, C16H13ClFN3S, the pyrazole ring adopts an envelope conformation with the methine C atom being the flap atom. The chloro- and fluorobenzene rings are twisted out of the plane of the pyrazole ring [dihedral angles = 15.12 (11) and 80.55 (10)°, respectively]. The amine group is orientated towards a ring N atom, forming an intramolecular N-H...N hydrogen bond. This H atom also forms a hydrogen bond to the F atom, which along with N-H...S hydrogen bonding leads to a supramolecular chain along the c axis. Connections between chains of the type Cl...[pi] lead to a layer in the bc plane.

Copyright © International Union of Crystallography
IUCr Webmaster