Acta Crystallographica Section E (Aug 2008)

1-Phenyl-2-(1H-1,2,4-triazol-1-yl)ethanone

  • Özden Özel Güven,
  • Hakan Tahtacı,
  • Simon J. Coles,
  • Tuncer Hökelek

DOI
https://doi.org/10.1107/S1600536808023258
Journal volume & issue
Vol. 64, no. 8
pp. o1604 – o1604

Abstract

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In the molecule of the title compound, C10H9N3O, the triazole and phenyl rings are nearly perpendicular to each other, with a dihedral angle of 88.72 (4)°. In the crystal structure, intermolecular C—H...O and C—H...N hydrogen bonds link the molecules. There are C—H...π contacts between the 1,2,4-triazole rings, and between the phenyl and 1,2,4-triazole rings, and there is a weak π–π contact between the 1,2,4-triazole and phenyl rings [centroid-to-centroid distance = 4.547 (1) Å].