4-（5,3'-二甲基-5'-氧代-2-苯基-2',5'-二氢-2H-[3,4']联吡唑-1'-基）苯磺酰胺一水合物
4-(5,3'-Dimethyl-5'-oxo-2-phenyl-2',5'-dihydro-2H-[3,4']bipyrazol-1'-yl)benzene-sulfonamide monohydrate.
作者信息
Asiri Abdullah M, Al-Youbi Abdulrahman O, Faidallah Hassan M, Alamry Khalid A, Ng Seik Weng
出版信息
Acta Crystallogr Sect E Struct Rep Online. 2011 Sep 1;67(Pt 9):o2474. doi: 10.1107/S1600536811034453. Epub 2011 Aug 27.
In the title compound, C(20)H(19)N(5)O(3)S·H(2)O, the pyrazole ring is connected to a pyrazolone ring, and the two five-membered rings are aligned at 45.0 (1)°. The pyrazole ring is connected to a phenyl ring and the two are twisted by 42.7 (1)°. Finally, the pyrazolone ring is connected to a benzene ring and the two are twisted by 19.5 (1)°. The N-H and -NH(2) portions and the solvent water mol-ecules are engaged in N-H⋯N, N-H⋯O and O-H⋯O hydrogen-bonding inter-actions to generate a three-dimensional network.
在标题化合物C(20)H(19)N(5)O(3)S·H(2)O中，吡唑环与吡唑啉酮环相连，两个五元环以45.0 (1)°的角度排列。吡唑环与苯环相连，二者扭转角度为42.7 (1)°。最后，吡唑啉酮环与苯环相连，二者扭转角度为19.5 (1)°。N-H和-NH(2)部分以及溶剂水分子参与N-H⋯N、N-H⋯O和O-H⋯O氢键相互作用，形成三维网络。
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