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

Crystal structure of 1-(2-chloro-acet-yl)-2,6-bis-(4-fluoro-phen-yl)-3,3-di-methyl-piperidin-4-one.

作者信息

Jothivel S, Kotoky Jibon, Kabilan S

机构信息

Department of Chemistry, Annamalai University, Annamalainagar 608 002, Chidambaram, Tamil Nadu, 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 Sect E Struct Rep Online. 2014 Sep 30;70(Pt 10):262-4. doi: 10.1107/S1600536814021278. eCollection 2014 Oct 1.

Abstract

In the title mol-ecule, C21H20ClF2NO2, the piperidine ring adopts a slightly distorted boat conformation. The two benzene rings form a dihedral angle of 87.43 (1)°. A weak intra-molecular C-H⋯π inter-action is observed. In the crystal, weak C-H⋯O hydrogen bonds and weak C-H⋯π inter-actions connect the mol-ecules, forming a three-dimensional network.

摘要

在标题分子C₂₁H₂₀ClF₂NO₂中,哌啶环呈轻微扭曲的船式构象。两个苯环形成的二面角为87.43 (1)°。观察到一个弱的分子内C—H⋯π相互作用。在晶体中,弱的C—H⋯O氢键和弱的C—H⋯π相互作用连接分子,形成三维网络。

https://cdn.ncbi.nlm.nih.gov/pmc/blobs/b58c/4257194/d1f85018b2a2/e-70-00262-fig1.jpg

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