STRUCTURE OF 2-(2,6-DIMETHOXYPHENYL)-7-HYDROXY-4H-1-BENZOPYRAN-4-ONE (7-HYDROXY-2',6'-DIMETHOXYFLAVONE)

被引:11
作者
WALLET, JC
GAYDOU, EM
ESPINOSA, E
OSORNO, O
MOLINS, E
MIRAVITLLES, C
机构
[1] CSIC,INST CIENCIA MAT BARCELONA,E-08193 CERDANYOLA,SPAIN
[2] UNIV COLOMBIA,FAC CIENCIAS,DEPT QUIM,BOGOTA,COLOMBIA
关键词
D O I
10.1107/S0108270191006285
中图分类号
O6 [化学];
学科分类号
0703 ;
摘要
C17H14O5, M(r) = 298.29, monoclinic, I2/a, a = 15.538 (6), b = 11.919 (4), c = 16.083 (4) angstrom, beta = 104.72 (12)-degrees, V = 2881 (2) angstrom 3, Z = 8, D(x) = 1.375 g cm-3, lambda(Mo K-alpha) = 0.71069 angstrom, mu = 0.95 cm-1, F(000) = 1248, T = 294 K, R = 0.051 for 1898 observed reflections [F > 1-sigma(F)]. The general shape of the molecule can be defined by two different regions: the chromone atoms including the O atom of the hydroxyl group lie in a plane, while the phenyl atoms including the O atoms of the methoxy groups lie in another plane. The angle between these mean planes is 68.2-degrees.
引用
收藏
页码:86 / 88
页数:3
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