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1-(2-氯乙酰基)-3,3-二甲基-2,6-二对甲苯基哌啶-4-酮的晶体结构

Crystal structure of 1-(2-chloro-acet-yl)-3,3-dimethyl-2,6-di-p-tolyl-piperidin-4-one.

作者信息

Jothivel S, Kotoky Jibon, Kabilan S

机构信息

Drug Discovery Lab., Department of Chemistry, Annamalai University, Annamalai Nagar, Tamil Nadu 608 002, India.

Division of Life Sciences, Central Instrumentation Facility, Institute of Advanced Study in Science & Technology (IASST), Guwahati 781 035, Assam, India.

出版信息

Acta Crystallogr E Crystallogr Commun. 2015 Feb 13;71(Pt 3):o173-4. doi: 10.1107/S2056989015002613. eCollection 2015 Mar 1.

DOI:10.1107/S2056989015002613
PMID:25844233
原文链接:https://pmc.ncbi.nlm.nih.gov/articles/PMC4350729/
Abstract

In the title compound, C23H26ClNO2, the piperidin-4-one ring adopts a distorted boat conformation. The two p-tolyl rings are nearly normal to each other, making a dihedral angle of 83.33 (10)°. They are inclined to the mean plane of the piperidine ring by 73.2 (1) and 87.22 (9)°. In the crystal, there are no significant inter-molecular inter-actions present.

摘要

在标题化合物C₂₃H₂₆ClNO₂中，哌啶-4-酮环呈扭曲的船式构象。两个对甲苯基环彼此近乎垂直，二面角为83.33 (10)°。它们相对于哌啶环的平均平面倾斜73.2 (1)°和87.22 (9)°。在晶体中，不存在明显的分子间相互作用。

https://cdn.ncbi.nlm.nih.gov/pmc/blobs/f0a7/4350729/e83e9807d6f2/e-71-0o173-fig1.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/f0a7/4350729/e83e9807d6f2/e-71-0o173-fig1.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/f0a7/4350729/e83e9807d6f2/e-71-0o173-fig1.jpg

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