（Z）-3-（4-氯苯基）-1-（2,4-二氟苯基）-2-（1H-1,2,4-三唑-1-基）丙-2-烯-1-酮
(Z)-3-(4-Chloro-phen-yl)-1-(2,4-difluoro-phen-yl)-2-(1H-1,2,4-triazol-1-yl)prop-2-en-1-one.
作者信息
Peng Xin-Mei, Yin Ben-Tao, Zhou Cheng-He
机构信息
Laboratory of Bioorganic & Medicinal Chemistry, School of Chemistry and Chemical Engineering, Southwest University, Chongqing 400715, People's Republic of China.
出版信息
Acta Crystallogr Sect E Struct Rep Online. 2012 Jun 1;68(Pt 6):o1828. doi: 10.1107/S1600536812022118. Epub 2012 May 19.
The asymmetric unit of the title compound, C(17)H(10)ClF(2)N(3)O, contains three independent mol-ecules. In each mol-ecule, the C=C bond has a cis conformation with respect to the triazole and chloro-phenyl groups. The dihedral angles formed by the triazole ring with the diflurophenyl and chloro-phenyl benzene rings, respectively, are 20.10 (14) and 73.22 (15), 25.31 (15) and 84.44 (15), and 16.44 (13) and 61.72 (14)° in the three mol-ecules while the dihedral angles between the benzene rings are 66.54 (13), 85.82 (12) and 58.37 (12)°.
标题化合物C(17)H(10)ClF(2)N(3)O的不对称单元包含三个独立分子。在每个分子中，C=C键相对于三唑和氯苯基呈顺式构象。在三个分子中，三唑环分别与二氟苯基和氯苯基苯环形成的二面角为20.10 (14)和73.22 (15)°、25.31 (15)和84.44 (15)°以及16.44 (13)和61.72 (14)°，而苯环之间的二面角为66.54 (13)°、85.82 (12)°和58.37 (12)°。
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