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2-氨基-4-甲基吡啶 3-氯苯甲酸盐

2-Amino-4-methyl-pyridinium 3-chloro-benzoate.

作者信息

Hemamalini Madhukar, Fun Hoong-Kun

机构信息

X-ray Crystallography Unit, School of Physics, Universiti Sains Malaysia, 11800 USM, Penang, Malaysia.

出版信息

Acta Crystallogr Sect E Struct Rep Online. 2010 Jun 26;66(Pt 7):o1843-4. doi: 10.1107/S160053681002444X.

DOI:10.1107/S160053681002444X
PMID:21588043
原文链接:https://pmc.ncbi.nlm.nih.gov/articles/PMC3006694/
Abstract

In the title salt, C(6)H(9)N(2) (+)·C(7)H(4)ClO(2) (-), the 2-amino-4-methyl-pyridinium cation is almost planar, with a maximum deviation of 0.010 (1) Å. In the crystal, the protonated N atom and the 2-amino group of the cation are hydrogen bonded to the carboxyl-ate O atoms of the anion via a pair of N-H⋯O hydrogen bonds, forming an R(2) (2)(8) ring motif. The ion pairs are further connected via N-H⋯O and C-H⋯O hydrogen bonds, forming a two-dimensional network parallel to the bc plane.

摘要

在标题盐C(6)H(9)N(2) (+)·C(7)H(4)ClO(2) (-)中,2-氨基-4-甲基吡啶阳离子几乎呈平面状,最大偏差为0.010 (1) Å。在晶体中,阳离子的质子化N原子和2-氨基通过一对N-H⋯O氢键与阴离子的羧酸根O原子形成氢键,形成R(2) (2)(8)环 motif。离子对通过N-H⋯O和C-H⋯O氢键进一步连接,形成平行于bc平面的二维网络。

https://cdn.ncbi.nlm.nih.gov/pmc/blobs/6fc7/3006694/75ce6438b13b/e-66-o1843-fig2.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/6fc7/3006694/124985c9e4b0/e-66-o1843-fig1.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/6fc7/3006694/75ce6438b13b/e-66-o1843-fig2.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/6fc7/3006694/124985c9e4b0/e-66-o1843-fig1.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/6fc7/3006694/75ce6438b13b/e-66-o1843-fig2.jpg

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