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首页> 外文期刊>X-ray Structure Analysis Online >Crystal Structure of 1-(Propa-1,2-dienyl)-1H-benzo(d)imidazole-2-carbaldehyde
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Crystal Structure of 1-(Propa-1,2-dienyl)-1H-benzo(d)imidazole-2-carbaldehyde

机译:1-(丙基-1,2-二烯基)-1H-苯并(d)咪唑-2-甲醛的晶体结构

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The structure of 1-(propa-1,2-dienyl)-1H-benzo[d]imidazole-2-carbaldehyde was determine by X-ray crystallography. The compound crystallized in a monoclinic system, and was characterized as: P21/n, a = 3.9124(8), b = 15.082(3), c = 15.407(3)Å, β = 91.784(4)°, Z = 4, V = 908.7(3)Å3. The crystal structure was solved by direct methods and refined by full-matrix least-squares on F2 to final values of R1 = 0.045 and wR2 = 0.133.
机译:通过X射线晶体学测定了1-(丙基1,2-二烯基)-1 H-苯并[咪唑]咪唑-2-甲醛的结构。该化合物在单斜晶系统中结晶,其特征在于: P 2 1 / n , a = 3.9124 (8), b = 15.082(3), c = 15.407(3)Å,β = 91.784(4)°, Z = 4, V = 908.7(3)Å 3 。通过直接方法解析晶体结构,并通过 F 2 上的全矩阵最小二乘法将其精炼为最终值 R 1 = 0.045和 wR 2 = 0.133。

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