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N-[4-氰基-3-(三氟甲基)苯基]-2-乙氧基苯甲酰胺

N-[4-Cyano-3-(trifluoro-meth-yl)phen-yl]-2-eth-oxy-benzamide.

作者信息

Naveen S, Manjunath H R, Sridhar M A, Shashidhara Prasad J, Rangappa K S

出版信息

Acta Crystallogr Sect E Struct Rep Online. 2010 Jun 5;66(Pt 7):o1533. doi: 10.1107/S1600536810019811.

DOI:10.1107/S1600536810019811
PMID:21587782
原文链接:https://pmc.ncbi.nlm.nih.gov/articles/PMC3006830/
Abstract

In the title compound, C(17)H(13)F(3)N(2)O(2), the two aromatic rings are essentially coplanar, forming a dihedral angle of 2.78 (12)°. The non-H atoms of the eth-oxy group are coplanar with the attached ring [maximum deviation = 0.271 (3) Å]. An intra-molecular N-H⋯O hydrogen bond occurs. In the crystal structure, mol-ecules are linked by inter-molecular C-H⋯N and C-H⋯F hydrogen bonds.

摘要

在标题化合物C₁₇H₁₃F₃N₂O₂中,两个芳环基本共面,形成的二面角为2.78 (12)°。乙氧基的非H原子与相连的环共面[最大偏差 = 0.271 (3) Å]。存在分子内N—H⋯O氢键。在晶体结构中,分子通过分子间C—H⋯N和C—H⋯F氢键相连。

https://cdn.ncbi.nlm.nih.gov/pmc/blobs/a4b2/3006830/51bdf473e14b/e-66-o1533-fig2.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/a4b2/3006830/6f82e2baba2e/e-66-o1533-fig1.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/a4b2/3006830/51bdf473e14b/e-66-o1533-fig2.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/a4b2/3006830/6f82e2baba2e/e-66-o1533-fig1.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/a4b2/3006830/51bdf473e14b/e-66-o1533-fig2.jpg

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