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2-溴-N-(2-羟基-5-甲基苯基)-2-甲基丙酰胺

2-Bromo-N-(2-hy-droxy-5-methyl-phen-yl)-2-methyl-propanamide.

作者信息

Moreno-Fuquen Rodolfo, Quintero David E, Zuluaga Fabio, Grande Carlos, Kennedy Alan R

出版信息

Acta Crystallogr Sect E Struct Rep Online. 2011 Sep 1;67(Pt 9):o2446. doi: 10.1107/S1600536811033150. Epub 2011 Aug 27.

DOI:10.1107/S1600536811033150
PMID:22065656
原文链接:https://pmc.ncbi.nlm.nih.gov/articles/PMC3200793/
Abstract

In the title mol-ecule, C(11)H(14)BrNO(2), there is twist between the mean plane of the amide group and the benzene ring [the C-N-C-C torsion angle is -172.1 (2)°]. The amide H atom forms an intra-molecular hydrogen bond with the Br atom. In the crystal, inter-molecular O-H⋯O and weak C-H⋯O hydrogen bonds link mol-ecules into a chain along [100].

摘要

在标题分子C(11)H(14)BrNO(2)中，酰胺基团的平均平面与苯环之间存在扭曲[C-N-C-C扭转角为-172.1 (2)°]。酰胺H原子与Br原子形成分子内氢键。在晶体中，分子间的O-H⋯O和弱C-H⋯O氢键将分子沿[100]方向连接成链。

https://cdn.ncbi.nlm.nih.gov/pmc/blobs/26ec/3200793/ac71de3124ba/e-67-o2446-fig2.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/26ec/3200793/2082856c274a/e-67-o2446-fig1.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/26ec/3200793/ac71de3124ba/e-67-o2446-fig2.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/26ec/3200793/2082856c274a/e-67-o2446-fig1.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/26ec/3200793/ac71de3124ba/e-67-o2446-fig2.jpg

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