| Literature DB >> 22719468 |
Xin Wu, Cai-Xia Yuan, Ling Ma, Kai-Lu Zhai, Miao-Li Zhu.
Abstract
The asymmetric unit of the title compound, C(12)H(13)BrN(4)OS, contains two independent mol-ecules in which the dihedral angles between the triazole and benzene rings are 2.9 (3) and 7.5 (3)°. The thione group is of the form R(2)C=S. An intra-molecular O-H⋯N hydrogen bond occurs in each mol-ecule. The crystal structure features weak N-H⋯S inter-actions and π-π stacking of the benzene rings [centroid-centroid distance = 3.667 (3) Å].Entities:
Year: 2012 PMID: 22719468 PMCID: PMC3379270 DOI: 10.1107/S1600536812019745
Source DB: PubMed Journal: Acta Crystallogr Sect E Struct Rep Online ISSN: 1600-5368