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N-(4-氯苯基)-2,2-二苯基乙酰胺

N-(4-Chloro-phen-yl)-2,2-diphenyl-acetamide.

作者信息

Fun Hoong-Kun, Loh Wan-Sin, Nayak Prakash S, Narayana B, Sarojini B K

出版信息

Acta Crystallogr Sect E Struct Rep Online. 2012 Aug 1;68(Pt 8):o2556-7. doi: 10.1107/S1600536812032965. Epub 2012 Jul 25.

DOI:10.1107/S1600536812032965
PMID:22904986
原文链接:https://pmc.ncbi.nlm.nih.gov/articles/PMC3414999/
Abstract

In the title compound, C(20)H(16)ClNO, an S(6) ring motif is formed via an intra-molecular C-H⋯O hydrogen bond. The chloro-substituted benzene ring is almost perpendicular to the benzene rings, forming dihedral angles of 87.33 (9) and 88.69 (9)°. The dihedral angle between the benzene rings is 87.17 (9)°. In the crystal, mol-ecules are linked into chains parallel to the c axis by inter-molecular N-H⋯O hydrogen bonds. The crystal packing also features weak C-H⋯π inter-actions involving the chloro-substituted ring.

摘要

在标题化合物C₂₀H₁₆ClNO中,通过分子内C-H⋯O氢键形成了一个S(6)环 motif。氯取代的苯环几乎垂直于苯环,形成的二面角为87.33 (9)°和88.69 (9)°。苯环之间的二面角为87.17 (9)°。在晶体中,分子通过分子间N-H⋯O氢键连接成平行于c轴的链。晶体堆积还具有涉及氯取代环的弱C-H⋯π相互作用。

https://cdn.ncbi.nlm.nih.gov/pmc/blobs/4d12/3414999/578d4420830c/e-68-o2556-fig2.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/4d12/3414999/9479ab63dda4/e-68-o2556-fig1.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/4d12/3414999/578d4420830c/e-68-o2556-fig2.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/4d12/3414999/9479ab63dda4/e-68-o2556-fig1.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/4d12/3414999/578d4420830c/e-68-o2556-fig2.jpg

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本文引用的文献

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Acta Crystallogr Sect E Struct Rep Online. 2012 May 1;68(Pt 5):o1316-7. doi: 10.1107/S1600536812014079. Epub 2012 Apr 6.
2
2,2-Diphenyl-N-(1,3-thia-zol-2-yl)acetamide.2,2-二苯基-N-(1,3-噻唑-2-基)乙酰胺
Acta Crystallogr Sect E Struct Rep Online. 2012 May 1;68(Pt 5):o1312-3. doi: 10.1107/S1600536812013840. Epub 2012 Apr 6.
3
N-(2,6-Dimethyl-phen-yl)-2,2-diphenyl-acetamide.N-(2,6-二甲基苯基)-2,2-二苯基乙酰胺
Acta Crystallogr Sect E Struct Rep Online. 2012 May 1;68(Pt 5):o1287-8. doi: 10.1107/S1600536812013451. Epub 2012 Apr 4.
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Structure validation in chemical crystallography.化学晶体学中的结构验证
Acta Crystallogr D Biol Crystallogr. 2009 Feb;65(Pt 2):148-55. doi: 10.1107/S090744490804362X. Epub 2009 Jan 20.
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