4-（1H-四唑-5-基）苯甲酸一水合物
4-(1H-Tetra-zol-5-yl)benzoic acid monohydrate.
作者信息
Li Guo-Qing, Wu A-Qing, Li Yan, Zheng Fa-Kun, Guo Guo-Cong
出版信息
Acta Crystallogr Sect E Struct Rep Online. 2008 Jun 28;64(Pt 7):o1368. doi: 10.1107/S1600536808019053.
Abstract
The asymmetric unit of the title compound, C(8)H(6)N(4)O(2)·H(2)O, consists of one 4-(1H-tetra-zol-5-yl)benzoic acid mol-ecule and one water mol-ecule. Hydrogen-bonding and π-π stacking (centroid-centroid distance between tetra-zole and benzene rings = 3.78 Å) inter-actions link the mol-ecules into a three-dimensional network.
摘要
标题化合物C(8)H(6)N(4)O(2)·H(2)O的不对称单元由一个4-(1H-四唑-5-基)苯甲酸分子和一个水分子组成。氢键和π-π堆积作用（四唑环与苯环之间的质心-质心距离 = 3.78 Å）将分子连接成三维网络。
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