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首页> 外文期刊>Journal of chemical crystallography >The Twinned Crystal Structure of Zinc(II) Acetylacetonate Trimer
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The Twinned Crystal Structure of Zinc(II) Acetylacetonate Trimer

机译:乙酰丙酮锌(II)三聚体的孪生晶体结构

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摘要

The crystal structure of the title compound, C30H42O12Zn3, originally determined from untwinned crystals (Bennett et al. Acta Cryst B 24:904, 1968) has been redetermined from twinned crystals. The effect of the twinning is that additional reflections appear in the diffraction pattern leading to a unit cell with a too long c-axis in which the structure cannot be solved. Thus, for a successful structure solution the correct unit cell has to be found and for refinement the twinning has to be taken into account. The central Zn atom is located on a twofold rotation axis. It is hexacoordinated in a distorted octahedral mode, whereas the coordination geometry of the two terminal Zn atoms is distorted trigonal bipyramidal.
机译:最初由未缠绕的晶体确定的标题化合物C30H42O12Zn3的晶体结构(Bennett等人,Acta Cryst B 24:904,1968)已从孪生晶体重新确定。孪生的效果是,衍射图样中会出现其他反射,从而导致c轴过长的晶胞无法解决结构。因此,对于成功的结构解决方案,必须找到正确的晶胞,并且为了改进必须考虑孪生。中心的Zn原子位于双重旋转轴上。它以扭曲的八面体模式进行六配位,而两个末端Zn原子的配位几何是扭曲的三角双锥体。

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