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

Autor: Özden Özel Güven, Hakan Tahtacı, Simon J. Coles, Tuncer Hökelek
Jazyk: angličtina
Rok vydání: 2008
Předmět:
Zdroj: Acta Crystallographica Section E, Vol 64, Iss 8, Pp o1604-o1604 (2008)
Druh dokumentu: article
ISSN: 16005368
1600-5368
DOI: 10.1107/S1600536808023258
Popis: 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].
Databáze: Directory of Open Access Journals