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4-（4-碘苯胺基）-2-亚甲基-4-氧代丁酸

4-(4-Iodo-anilino)-2-methyl-ene-4-oxo-butanoic acid.

作者信息

Nayak Prakash S, Narayana Badiadka, Yathirajan Hemmige S, Gerber Thomas, van Brecht Benjamin, Betz Richard

机构信息

Mangalore University, Department of Studies in Chemistry, Mangalagangotri 574 199, India.

出版信息

Acta Crystallogr Sect E Struct Rep Online. 2013 Jan 1;69(Pt 1):o83. doi: 10.1107/S160053681205012X. Epub 2012 Dec 15.

DOI:10.1107/S160053681205012X
PMID:23476465
原文链接:https://pmc.ncbi.nlm.nih.gov/articles/PMC3588263/
Abstract

In the title compound, C11H10INO3, an addition product of itaconic acid anhydride and 4-iodo-aniline, the least-squares planes defined by the atoms of the aromatic moiety and the non-H atoms of the carb-oxy-lic acid group enclose an angle of 74.82 (11)°. In the crystal, classical O-H⋯O hydrogen bonds formed by carb-oxy-lic groups, as well as N-H⋯O hydrogen bonds formed by amide groups, are present along with C-H⋯O contacts. Together, these connect the mol-ecules into dimeric chains along the b-axis direction.

摘要

在标题化合物C₁₁H₁₀INO₃（衣康酸酐与4-碘苯胺的加成产物）中，由芳族部分的原子和羧酸基团的非H原子所定义的最小二乘平面夹角为74.82 (11)°。在晶体中，存在由羧基形成的经典O-H⋯O氢键、由酰胺基形成的N-H⋯O氢键以及C-H⋯O接触。这些共同作用，将分子沿b轴方向连接成二聚链。

https://cdn.ncbi.nlm.nih.gov/pmc/blobs/49e4/3588263/42500b2d8689/e-69-00o83-fig3.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/49e4/3588263/716727466dff/e-69-00o83-fig1.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/49e4/3588263/04613cc3d846/e-69-00o83-fig2.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/49e4/3588263/42500b2d8689/e-69-00o83-fig3.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/49e4/3588263/716727466dff/e-69-00o83-fig1.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/49e4/3588263/04613cc3d846/e-69-00o83-fig2.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/49e4/3588263/42500b2d8689/e-69-00o83-fig3.jpg

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