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Ethyl 1-phenyl-1,4-di-hydro-indeno-[1,2-c]pyrazole-3-carboxyl-ate

机译:乙基1-苯基-1,4-二氢 - Indeno-[1,2-C]吡唑-3-羧基 - 吃

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摘要

The non-H atoms of the title mol-ecule, C 19 H 16 N 2 O 2 , are almost coplanar (r.m.s. deviation = 0.019??), apart from the phenyl group, which is disordered with two components of almost equal occupancy: the dihedral angle between them is 78.9?(3)°. In the crystal, weak C—H?N hydrogen bonds link the mol-ecules into [001] chains and aromatic π – π stacking inter-actions [shortest centroid–centroid separation = 3.747?(2)??] form columns parallel to the c -axis direction.
机译:除了苯基之外,标题Mol-Ecule,C 19 H 16 N 2 O 2的非H原子几乎是共面(RMS偏差=0.019≤0.019Ω),其与几乎相同占用的两个组分无序:它们之间的二面角是78.9?(3)°。在晶体中,弱的C-H·N氢键将摩尔果生物连接到链条和芳族π - π堆叠互动互作次[最短质心分离=3.747≤3.747??]形成柱状的柱状C轴方向。

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