NiC4H4O6·2.5H2O的晶体生长与结构

Takanori Fukami, Shuta Tahara
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摘要

采用硅胶凝胶法制备半五水酒石酸镍单晶NiC4H4O6·2.5H2O。用单晶x射线衍射法测定了晶体结构。其结构为正交结构,空间群为P212121,晶格常数为a = 7.8578(3) Å, b = 11.0988(5) Å, c = 18.0529(8) Å,由NiO6八面体、C4H4O6和H2O分子、C4H4O6–Ni–C4H4O6链和相邻分子之间的O–H·· O氢键框架组成。与其他酒石酸盐化合物类似,C4H4O6分子含有单键和双键C–O键和单键C–C键。讨论了第一过渡金属系不同阳离子诱导酒石酸盐化合物的化学式和结构的差异。
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Crystal Growth and Structure of NiC4H4O6·2.5H2O
Single crystals of nickel tartrate hemi-pentahydrate, NiC4H4O6·2.5H2O, were grown by the gel method using silica gels. The crystal structure was determined by the single-crystal X-ray diffraction method. Its structure was orthorhombic with space group P212121 and lattice constants a = 7.8578(3) Å, b = 11.0988(5) Å, and c = 18.0529(8) Å, and consisted of slightly distorted NiO6 octahedra, C4H4O6 and H2O molecules, C4H4O6–Ni–C4H4O6 chains containing H2O molecules, and O–H···O hydrogen-bonded frameworks between adjacent molecules. The C4H4O6 molecules contained both single and double C–O bonds, and single C–C bonds, similar to other tartrate compounds. We discussed the differences in the chemical formulae and structures of tartrate compounds induced by different cations of the first transition metal series.
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