6-氧代-5-[(三氟甲基)磺酰基]-1,2,4a,5,6,11b-六氢-1,3-二氧杂环戊烯并[4,5-j]菲啶-2-基苯甲酸酯
6-Oxo-5-[(trifluoro-meth-yl)sulfon-yl]-1,2,4a,5,6,11b-hexa-hydro-1,3-dioxolo[4,5-j]phenanthridin-2-yl benzoate.
作者信息
Wu Chunli, Li Pan, Shi Xiufang, Pan Xiaotao, Wu Jizhou
出版信息
Acta Crystallogr Sect E Struct Rep Online. 2011 Jan 15;67(Pt 2):o382. doi: 10.1107/S1600536811001085.
Abstract
In the title compound, C(22)H(16)F(3)NO(7)S, the two benzene rings are almost perpendicular, the dihedral angle between their mean planes being 87.1 (1)°. The terminal O atom of the benzoate moiety is disordered over two positions with site occupancies of 0.244 (15) and 0.756 (15). The crystal structure is stablized by two types of weak inter-molecular C-H⋯O hydrogen bonds.
摘要
在标题化合物C₂₂H₁₆F₃NO₇S中，两个苯环几乎相互垂直，它们平均平面之间的二面角为87.1（1）°。苯甲酸酯部分的末端O原子在两个位置上无序，占位比分别为0.244（15）和0.756（15）。晶体结构通过两种类型的弱分子间C-H⋯O氢键得以稳定。
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