首页> 美国卫生研究院文献>Acta Crystallographica Section E: Crystallographic Communications >Crystal structures of (E)-(3-ethyl-1-methyl-26-di­phenyl­piperidin-4-yl­idene)amino phenyl carbonate and (E)-(3-isopropyl-1-methyl-26-di­phenyl­piperidin-4-yl­idene)amino phenyl carbonate
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Crystal structures of (E)-(3-ethyl-1-methyl-26-di­phenyl­piperidin-4-yl­idene)amino phenyl carbonate and (E)-(3-isopropyl-1-methyl-26-di­phenyl­piperidin-4-yl­idene)amino phenyl carbonate

机译:(E)-(3-乙基-1-甲基-26-二苯基哌啶-4-亚甲基)氨基碳酸苯酯和(E)-(3-异丙基-1-甲基-26-二苯基哌啶-4)的晶体结构-亚苯基)氨基苯基碳酸酯

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摘要

In the title compounds, C27H28N2O3, (I), and C28H30N2O3, (II), the conformation about the C=N bond is E. The piperidine rings adopt chair conformations with the attached phenyl rings almost normal to their mean planes, the dihedral angles being 85.82 (8) and 85.84 (7)° in (I), and 87.98 (12) and 86.42 (13)° in (II). The phenyl rings are inclined to one another by 52.87 (8)° in (I) and by 60.51 (14)° in (II). The main difference in the conformation of the two compounds is the angle of inclination of the phen­oxy­carbonyl ring to the piperidine ring mean plane. In (I), these two planes are almost coplanar, with a dihedral angle of 2.05 (8)°, while in (II), this angle is 45.24 (13)°. In the crystal of (I), mol­ecules are linked by C—H⋯O hydrogen bonds, forming inversion dimers with R 2 2(14) loops. The dimers are linked via C—H⋯π inter­actions forming a three-dimensional network. In the crystal of (II), there are no significant inter­molecular inter­actions present.
机译:在标题化合物C27H28N2O3(I)和C28H30N2O3(II)中,关于C = N键的构象为E。哌啶环采用椅子构象,其连接的苯环几乎垂直于其平均平面(二面角) (I)中为85.82(8)和85.84(7)°,以及(II)中为87.98(12)和86.42(13)°。苯环在(I)中相互倾斜52.87(8)°,在(II)中相互倾斜60.51(14)°。两种化合物的构象的主要区别是苯氧羰基羰基环与哌啶环平均平面的倾斜角。在(I)中,这两个平面几乎共面,二面角为2.05(8)°,而在(II)中,该角为45.24(13)°。在(I)的晶体中,分子通过CHHO氢键连接,形成具有R 2 2 (14)环的反型二聚体。二聚体通过CH键相互作用形成三维网络。在(II)的晶体中,不存在明显的分子间相互作用。

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