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(3E,5E)-3,5-双(4-甲基-亚苄基)-1-[3-(哌啶-1-基)丙酰基]哌啶-4-酮

(3E,5E)-3,5-Bis(4-methyl-benzyl-idene)-1-[3-(piperidin-1-yl)propano-yl]piperidin-4-one.

作者信息

Kia Yalda, Osman Hasnah, Murugaiyah Vikneswaran, Arshad Suhana, Razak Ibrahim Abdul

出版信息

Acta Crystallogr Sect E Struct Rep Online. 2012 Aug 1;68(Pt 8):o2493-4. doi: 10.1107/S1600536812031820. Epub 2012 Jul 18.

DOI:10.1107/S1600536812031820
PMID:22904935
原文链接:https://pmc.ncbi.nlm.nih.gov/articles/PMC3414948/
Abstract

In the title compound, C(29)H(34)N(2)O(2), the central piperidine ring adopts a half-chair conformation, whereas the terminal one adopts a chair conformation. The mean plane of the central piperidine ring [maximum deviation = 0.384 (2) Å] makes dihedral angles of 64.82 (13) and 17.55 (13)° with the benzene rings. In the crystal, mol-ecules are linked into a tape along the b axis via C-H⋯O inter-actions, generating R(2) (2)(20) and R(2) (1)(6) graph-set motifs. C-H⋯π inter-actions are observed between the tapes.

摘要

在标题化合物C(29)H(34)N(2)O(2)中,中心哌啶环呈半椅式构象,而末端哌啶环呈椅式构象。中心哌啶环的平均平面[最大偏差 = 0.384 (2) Å]与苯环的二面角分别为64.82 (13)°和17.55 (13)°。在晶体中,分子通过C—H⋯O相互作用沿b轴连接成一条链,形成R(2) (2)(20)和R(2) (1)(6) 图形集 motif。在这些链之间观察到C—H⋯π相互作用。

https://cdn.ncbi.nlm.nih.gov/pmc/blobs/1fd9/3414948/43bca2c88471/e-68-o2493-fig2.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/1fd9/3414948/7830aec57421/e-68-o2493-fig1.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/1fd9/3414948/43bca2c88471/e-68-o2493-fig2.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/1fd9/3414948/7830aec57421/e-68-o2493-fig1.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/1fd9/3414948/43bca2c88471/e-68-o2493-fig2.jpg

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