Wang Wei, Fang Zheng
College of Life Sciences and Pharmaceutical Engineering, Nanjing University of Technolgy, Xinmofan Road No. 5 Nanjing, Nanjing 210009, People's Republic of China.
Acta Crystallogr Sect E Struct Rep Online. 2008 Nov 22;64(Pt 12):o2413. doi: 10.1107/S1600536808038105.
The asymmetric unit of the title compound, C(17)H(11)Cl(3)N(2)O(2), contains two independent mol-ecules; the pyrazole rings are oriented with respect to the chloro-phenyl and dichloro-phenyl rings at dihedral angles of 43.00 (3) and 65.06 (4)°, respectively, in one mol-ecule, and 51.17 (3) and 69.99 (3)°, respectively, in the other. Pairs of inter-molecular O-H⋯O hydrogen bonds link the mol-ecules into dimers. In the crystal structure, there are π-π contacts between the pyrazole rings and dichloro-phenyl rings [centroid-centroid distances = 3.859 (3) and 3.835 (3) Å].
标题化合物C(17)H(11)Cl(3)N(2)O(2)的不对称单元包含两个独立分子;在一个分子中,吡唑环相对于氯苯基和二氯苯基环的二面角分别为43.00 (3)°和65.06 (4)°,在另一个分子中分别为51.17 (3)°和69.99 (3)°。分子间的O-H⋯O氢键对将分子连接成二聚体。在晶体结构中,吡唑环和二氯苯基环之间存在π-π接触[质心-质心距离 = 3.859 (3)和3.835 (3) Å]。