Crystal structure of chlorido­bis­[(1,2,5,6-η)-cyclo­octa-1,5-diene]iridium(I)

Rahman A.K.F.; Wilklow-Marnell M.; Brennessel W.W.; Jones W.D.

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Crystal structure of chloridobis[(1,2,5,6-η)-cycloocta-1,5-diene]iridium(I)

机译：氯双[[1,2,5,6-η）-环辛-1,5-二烯]铱（I）的晶体结构

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The title complex, [IrCl(C8H12)2], was synthesized directly from the reaction of IrCl3·3H2O with a large excess of cod (cod = cycloocta-1,5-diene) in alcoholic solvent. Large yellow needles were obtained by the slow cooling of a hot solution. Based on the positions of the chloride ligand and the mid-points of the four C=C bonds, the molecule adopts a five-coordinate geometry that is midway between square pyramidal and trigonal bipyramidal. The material crystallizes in the orthorhombic space group Pbca with one molecule per asymmetric unit in a general position and shows no significant intermolecular interactions. Individual molecules are aligned along [010], and these rows form a pseudo-hexagonal packing arrangement.

机译：标题配合物[IrCl（C8H12）2]由IrCl3·3H2O与大量过量的鳕鱼（鳕鱼=环辛-1,5-二烯）在酒精溶剂中的反应直接合成。通过缓慢冷却热溶液获得大的黄色针状物。根据氯化物配体的位置和四个C = C键的中点，分子采用五坐标几何结构，介于方形金字塔形和三角形双锥体之间。该材料在正交位置的Pbca空间群中结晶，每个分子中的每个不对称单元在一般位置上结晶，并且没有明显的分子间相互作用。各个分子沿[010]排列，并且这些行形成伪六边形堆积排列。

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《Acta Crystallographica Section E: Crystallographic Communications》 |2017年第2期|共5页
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Rahman A.K.F.; Wilklow-Marnell M.; Brennessel W.W.; Jones W.D.;
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中图分类晶体学;
关键词
CRYSTAL STRUCTUREIRIDIUM1,5-CYCLOOCTADIENEFIVE-COORDINATE COMPLEX;

机译：晶体结构铱1,5-环十二碳五坐标复合物;

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机译：偶然制备fac-（乙腈-κN）三氯化碘[（1,2,5,6-η）-cycloocta-1,5-diene]铱（III）
2. [(1,2,5,6-η)-Cycloocta-1,5-diene]bis(1-isopropyl-3-methylimidazolin-2-ylidene)rhodium(I) tetrafluoridoborate [J] . Nichol G.S., Rajaseelan E., Rajaseelan J., Acta Crystallographica Section E: Crystallographic Communications . 2011,第12期

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4. Intercrystallite Diffusion of ~(57)Co and ~(195)Au in Iridium Polycrystals. The Structure and Physical Properties of States Populated by ~(57)Co During Intercrystallite Diffusion [C] . N.I. Timofeev, G.F. Kuzmenko, A.V. Ermakov, International conference on diffusion in materials . 2001

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7. Crystal structure of chloridobis[(1,2,5,6-η)-cycloocta-1,5-diene]iridium(I) [O] . A. K. Fazlur Rahman, Miles Wilklow-Marnell, William W. Brennessel, 2017

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机译：顺式和反式-1,4-双（三甲基甲硅烷基）六甲基-1,4-二硅杂环己烷-2,5-二烯的构象研究和晶体结构

Crystal structure of chlorido­bis­[(1,2,5,6-η)-cyclo­octa-1,5-diene]iridium(I)

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Crystal structure of chloridobis[(1,2,5,6-η)-cycloocta-1,5-diene]iridium(I)