[HTML version][PDF version][CIF][3d view][Structure Factors][Supplementary Material][CIF check Report][Issue contents]  [Open access]

[Contents scheme]

Acta Cryst. (2013). E69, o1083-o1084  [ doi:10.1107/S1600536813014840 ]

4-{5-[(2-Bromobenzyl)sulfanyl]-1H-tetrazol-1-yl}benzoic acid

A. C. Mafud, Y. P. Mascarenhas and A. S. Nascimento

Abstract: In the title compound, C15H11BrN4O2S, the tetrazole ring makes dihedral angles of 45.97 (10) and 75.41 (1)°, respectively, with the benzoyl and bromobenzene rings while the dihedral angle between the benzene rings is 73.77 (1)°. In the crystal, molecules are linked through O-H... N and C-H... O hydrogen bonds, giving infinite chains in both the [110] and [1-10] directions. These chains are further connected by C-Br...[pi] and C-O...[pi] interactions and also by [pi]-[pi] stacking between tetrazole rings [centroid-centroid distance = 3.312 (1) Å], generating a three-dimensional network.


Copyright © International Union of Crystallography
IUCr Webmaster