首页> 美国卫生研究院文献>Acta Crystallographica Section E: Crystallographic Communications >Crystal structures of 2′-benzoyl-1′-(4-methyl­phenyl)-11′22′5′6′7′7a′-octa­hydro­spiro­indole-33′-pyrrolizin-2-one and 2′-(4-bromo­benzoyl)-1′-(2-chloro­phen­yl)-11′22′5′6′7′7a′-octa­hydro­spiro­indole-33′-pyrrolizin-2-one
【2h】

Crystal structures of 2′-benzoyl-1′-(4-methyl­phenyl)-11′22′5′6′7′7a′-octa­hydro­spiro­indole-33′-pyrrolizin-2-one and 2′-(4-bromo­benzoyl)-1′-(2-chloro­phen­yl)-11′22′5′6′7′7a′-octa­hydro­spiro­indole-33′-pyrrolizin-2-one

机译:2-苯甲酰基-1-(4-甲基苯基)-11225677a-八氢螺吲哚-33-吡咯嗪的晶体结构-2-one和2-(4-溴苯甲酰基)-1-(2-氯苯基)-11225677a-八氢螺吲哚-3 3-吡咯嗪 -2-一

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摘要

The two title compounds, C28H26N2O2, (I), and C27H22BrClN2O2, (II), differ in their substituents, viz.4-methyl­phenyl and benzoyl rings in (I) replaced by 2-chloro­phenyl and 4- bromo­benzoyl, respectively, in (II). A significant difference between the two mol­ecules is found in the deviation of the benzoyl O atom from the least-squares plane of the ring to which it is attached [0.593 (4) and 0.131 (3) Å, respectively], a fact which may be attributed to the different participation of the benzoyl O atoms as acceptors in their inter­molecular C—H⋯O inter­actions. The chemical modifications in (I) and (II) do not seem to affect the type nor strength of the inter­molecular N—H⋯N and C—H⋯O hydrogen bonds responsible for the two crystal structures, such that the aggregation of mol­ecules appears similar in spite of the mol­ecular changes.
机译:两种标题化合物C28H26N2O2(I)和C27H22BrClN2O2(II)的取代基不同,(I)中的4-甲基苯基和苯甲酰基环分别由(II)中的2-氯苯基和4-溴苯甲酰基取代)。发现这两个分子之间存在显着差异,即苯甲酰基O原子与其所连接的环的最小二乘方平面的偏差[分别为0.593(4)和0.131(3)Å],这归因于苯甲酰基O原子作为受体在其分子间CHH相互作用中的不同参与。 (I)和(II)中的化学修饰似乎不影响负责两个晶体结构的分子间NH-NH和CHH-O氢键的类型或强度,从而不会出现分子聚集尽管分子发生了变化,但相似。

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