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1-(4-Meth-oxy-phen-yl)-2-(1H-1,2,4-triazol-1-yl)ethanone.

ABSTRACT: In the title compound, C(11)H(11)N(3)O(2), the dihedral angle between the central ethanone fragment and the 4-meth-oxy-phenyl group is 2.9?(2)°, while that between the ethanone fragment and the triazole ring is 83.4?(2)°. The dihedral angle between the planes of the triazole and benzene rings is 81.7?(1)°. The 4-meth-oxy-phenyl group is cis with respect to the ethanone fragment O atom across the exocyclic C-C bond. In the crystal, mol-ecules are linked by C-H?N inter-actions into C(9) chains along [001].

SUBMITTER: Kesternich V 

PROVIDER: S-EPMC3007452 | biostudies-literature | 2010 Jul

REPOSITORIES: biostudies-literature

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1-(4-Meth-oxy-phen-yl)-2-(1H-1,2,4-triazol-1-yl)ethanone.

Kesternich Victor V   Brito Iván I   Bolte Michael M   Pérez-Fermann Marcia M   Nelson Ronald R  

Acta crystallographica. Section E, Structure reports online 20100710 Pt 8

In the title compound, C(11)H(11)N(3)O(2), the dihedral angle between the central ethanone fragment and the 4-meth-oxy-phenyl group is 2.9 (2)°, while that between the ethanone fragment and the triazole ring is 83.4 (2)°. The dihedral angle between the planes of the triazole and benzene rings is 81.7 (1)°. The 4-meth-oxy-phenyl group is cis with respect to the ethanone fragment O atom across the exocyclic C-C bond. In the crystal, mol-ecules are linked by C-H⋯N inter-actions into C(9) chains alo  ...[more]

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