Crystal structure of 4-methylpyridinium 2,4-dinitrophenolate

被引:4
|
作者
Jin, ZM [1 ]
Yan, JZ
Lü, YP
He, L
Sun, N
机构
[1] Zhejiang Univ Technol, Coll Pharmaceut Sci, Hangzhou 310014, Peoples R China
[2] Zhejiang Univ, Dept Chem, Hangzhou 310027, Peoples R China
关键词
2,4-dinitrophenol; 4-methylpyridine; bifurcated hydrogen bonding; CHO hydrogen bond; pi-pi interaction;
D O I
10.1023/A:1014362225482
中图分类号
O7 [晶体学];
学科分类号
0702 ; 070205 ; 0703 ; 080501 ;
摘要
A crystalline salt of 4-methylpyridinium 2,4-dinitrophenolate has been prepared and characterized by X-ray crystallography. The salt crystallizes in the monoclinic space group P2(1/c), with a = 9.105(2), b = 7.617(2), c = 18.424(3) Angstrom, alpha = 90.00, beta = 101.19(1), gamma = 90.00degrees, V = 125 3.5 (5) Angstrom(3), and Z=4. In the title salt, the phenolate and pyridinium ion are held by bifurcated hydrogen bonds of N-H...O, and are arranged in an almost coplanar manner to each other due to two sets of CHO hydrogen bonds. The geometrical arrangement in the title salt is characterized by the formation of herringbone motif of 4-methylpyridinium 2,4-dinitrophenolate. The herringbone motif is stablized by CHO hydrogen bonds. The face-to-face interval between the phenolate and pyridinium ring is 3.3094 Angstrom, in a range governed by pi-pi interaction.
引用
收藏
页码:345 / 348
页数:4
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