Zheng Chunyang, Wang Dunjia, Fan Ling
Acta Crystallogr Sect E Struct Rep Online. 2008 Dec 20;65(Pt 1):o160-1. doi: 10.1107/S1600536808042566.
In the title compound, C(21)H(16)O(2), the six crystallographically independent mol-ecules (Z' = 6) all exist in the enolized form. Strong intra-molecular hydrogen bonds are observed: one approximate H-atom-centered O⋯H⋯O hydrogen bond, two tautomeric forms O-H⋯O (three mol-ecules) and O⋯H-O (two mol-ecules). Only one weak inter-molecular C-H⋯O hydrogen bond between two neighboring mol-ecules is observed in the crystal structure. In addition, eight very weak non-conventional inter-molecular C-H⋯π hydrogen-bonding contacts between mol-ecules are observed.
在标题化合物C₂₁H₁₆O₂中,六个晶体学独立分子(Z' = 6)均以烯醇化形式存在。观察到强分子内氢键:一个近似以氢原子为中心的O⋯H⋯O氢键、两种互变异构形式O-H⋯O(三个分子)和O⋯H-O(两个分子)。在晶体结构中仅观察到两个相邻分子之间的一个弱分子间C-H⋯O氢键。此外,还观察到分子之间的八个非常弱的非常规分子间C-H⋯π氢键接触。