In the mol-ecule of the title compound, C(10)H(9)N(3)O, the triazole and phenyl rings are nearly perpendicular to each other, with a dihedral angle of 88.72â (4)°. In the crystal structure, inter-molecular C-Hâ¯O and C-Hâ¯N hydrogen bonds link the mol-ecules. There are C-Hâ¯Ï contacts between the 1,2,4-triazole rings, and between the phenyl and 1,2,4-triazole rings, and there is a weak Ï-Ï contact between the 1,2,4-triazole and phenyl rings [centroid-to-centroid distance = 4.547â (1)â à ].
1-Phenyl-2-(1H-1,2,4-triazol-1-yl)ethanone.
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作者:Ozel Güven Ozden, Tahtacı Hakan, Coles Simon J, Hökelek Tuncer
| 期刊: | Acta Crystallographica Section E-Structure Reports Online | 影响因子: | 0.600 |
| 时间: | 2008 | 起止号: | 2008 Jul 26; 64(Pt 8):o1604 |
| doi: | 10.1107/S1600536808023258 | ||
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