1.
Acta Crystallogr Sect E Struct Rep Online
; 70(Pt 5): o574-5, 2014 May 01.
Article
in English
| MEDLINE
| ID: mdl-24860378
ABSTRACT
The title compound, C11H11ClN4OS, crystallizes with two mol-ecules, A and B, in the asymmetric unit in which the dihedral angles between the triazole and benzene rings are 54.6â (3) and 56.0â (3)°. Both mol-ecules feature an intra-molecular O-Hâ¯N hydrogen bond, which generates an S(6) ring. In the crystal, A-B dimers are linked by pairs of weak C-Hâ¯S hydrogen bonds along with π-π stacking inter-actions between the triazole rings [centroid-centroid separations = 3.631â (3) and 3.981â (4)Å]. N-Hâ¯S hydrogen bonds link the dimers into [100] chains, which feature R 2 (2)(8) loops.