首页> 外文期刊>Journal of structural chemistry >Single Crystal X-Ray Structural Analysis of Two Polymorphs of Ethyl 2-(2-Chlorophenyl)-4-Hydroxy-5-Oxo-1-Phenyl-2,5-Dihydro-1H-Pyrrole-3-Carboxylate
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Single Crystal X-Ray Structural Analysis of Two Polymorphs of Ethyl 2-(2-Chlorophenyl)-4-Hydroxy-5-Oxo-1-Phenyl-2,5-Dihydro-1H-Pyrrole-3-Carboxylate

机译:2-(2-氯苯基)-4-羟基-5-氧代-1-苯基-2,5-二氢-1H-吡咯-3-羧酸乙酯的两种多晶型物的单晶X射线结构分析

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摘要

A single crystal X-ray structure analysis of two polymorphs of ethyl 2-(2-chlorophenyl)-4-hydroxy-5-oxo-1-phenyl-2,5-dihydro-1H-pyrrole-3-carboxylate, i.e. I (Z = 1) and II (Z = 4), is performed. It is shown that the molecular geometries are the same in I and II, and the same bifurcated O-HO hydrogen bonds (involving hydroxyl and ester C=O groups) exist between the adjacent molecules, giving rise to molecular dimers which, however, are different in I and II: centrosymmetric (heterochiral) and homochiral, respectively.
机译:单晶X射线结构分析2-(2-氯苯基)-4-羟基-5-氧代-1-苯基-2,5-二氢-1H-吡咯-3-羧酸盐,即i( 进行Z = 1)和II(Z = 4)。 结果表明,在I和II中,分子几何形状是相同的,并且在相邻分子之间存在相同的分叉的O-HO氢键(涉及羟基和酯C = O基团),产生分子二聚体,但是 不同于I和II:Centroosymmetric(异质血红素)和Homochiral。

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