Acta Crystallographica Section E (Jan 2012)

4-(4-Bromophenyl)-1-(2,6-difluorobenzyl)-3-(3,4,5-trimethoxyphenyl)-1H-1,2,4-triazole-5(4H)-thione

  • Hoong-Kun Fun,
  • Chin Wei Ooi,
  • B. Chandrakantha,
  • Arun M. Isloor,
  • Prakash Shetty

DOI
https://doi.org/10.1107/S1600536811052330
Journal volume & issue
Vol. 68, no. 1
pp. o89 – o89

Abstract

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In the title compound, C24H20BrF2N3O3S, the triazole ring (r.m.s. deviation = 0.0107 Å) makes dihedral angles of 28.18 (14), 63.76 (14) and 77.01 (18)°, respectively, with the trimethoxy-, bromo-, and difluoro-substituted benzene rings. The C atoms of the meta methoxy groups are roughly coplanar with their ring [displacements = −0.289 (4) and 0.083 (7) Å], whereas the C atom of the para group is displaced [1.117 (3) Å]. In the crystal, inversion dimers linked by two pairs of C—H...O hydrogen bonds occur. The ring motif of the two hydrogen bonds to their symmetry-generated O-atom acceptors is R22(8).