1.
Acta Crystallogr E Crystallogr Commun
; 76(Pt 2): 162-166, 2020 Feb 01.
Artigo
em Inglês
| MEDLINE
| ID: mdl-32071740
RESUMO
In the title compound, C18H19BrFN3S, the 1,2,4-triazole ring is nearly planar with a maximum deviation of -0.009â (3) and 0.009â (4)â Å, respectively, for the S-bound C atom and the N atom bonded to the bromo-fluoro-phenyl ring. The phenyl and triazole rings are almost perpendicular to each other, forming a dihedral angle of 89.5â (2)°. In the crystal, the mol-ecules are linked by weak C-Hâ¯π(phen-yl) inter-actions, forming supra-molecular chains extending along the c-axis direction. The crystal packing is further consolidated by inter-molecular N-Hâ¯S hydrogen bonds and by weak C-Hâ¯S inter-actions, yielding double chains propagating along the a-axis direction. The crystal studied was refined as a racemic twin.