Crystaland molecular structure of 4,4'-bipyridinium bis(trans-2-hydroxycinnamate) bis(4,4'-bipyridine)

被引:0
作者
Zhang, Y. Y. [1 ]
Gio, Y. [1 ]
Chen, H. X. [2 ]
Xu, W. J. [1 ]
Jin, Z. M. [1 ]
机构
[1] Zhejiang Univ Technol, Coll Pharmaceut Sci, Hangzhou 310014, Zhejiang, Peoples R China
[2] Zhejiang Sci Tech Univ, Analyt Ctr, Hangzhou 310018, Zhejiang, Peoples R China
关键词
whole molecule disorder; hydrogen bond; co-crystal; hydroxycinnamate; ortho-coumaric acid; 4,4 '-bipyridine; 4,4'-BIPYRIDYL; PATTERNS;
D O I
10.1007/s10947-009-0181-1
中图分类号
O61 [无机化学];
学科分类号
070301 ; 081704 ;
摘要
4,4'-Bipyridinium bis(trans-2-hydroxycinnamate) bis(4,4'-bipyridine), 0.5(C10H10N2)(2+) (C9H7O3)(-)center dot C10H8N2, crystallizes in triclinic system, space group P-1, with a = 7.4211(8) b = 9.9516(11) , c = 13.8587(15), beta = 92.510(2)A degrees, alpha = 96.772(2)A degrees, gamma = 99.164(2)A degrees, V = 1001.33(19) (3), rho(calc) = 1.321 g/cm(3), Z = 2. In the crystal, the whole trans-2-hydroxycinnamate is disordered over two sites with different occupancies. The molecular species are linked by O-Ha <-N and N-Ha <-O hydrogen bonds into five-molecule hydrogen bonded chain associates that are further linked by C-Ha <-O hydrogen bonds into layers with the major orientation of the disordered 2-hydroxycinnamate. However such hydrogen bonds are not observed with the minor orientation.
引用
收藏
页码:1208 / 1211
页数:4
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