Crystal structure of {3-[3,5-bis-(2,6-di-methyl-phen-yl)-1,2-phenyl-ene]-1-(2,6,2'',6''-tetra-methyl-1,1':3',1''-ter-phen-yl-5'-yl)imidazol-2-yl-idene}chlorido-(η(6)-p-cymene)ruthenium(II) benzene disolvate.

IF 0.9 Acta crystallographica. Section E, Structure reports online Pub Date : 2014-11-08 eCollection Date: 2014-12-01 DOI:10.1107/S160053681402399X
Shohei Sase, Yuriko Ikehara, Kei Goto
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Abstract

The title compound, [Ru(C47H43N2)Cl(C10H14)]·2C6H6, crystallized with two independent mol-ecules of benzene. One of the N-aryl moieties of the N-heterocyclic carbene (NHC) ligand underwent cyclo-metallation to form a five-membered ruthenacycle. The complex has a three-legged piano-stool structure with two C atoms incorporated in the five-membered ruthenacycle and a Cl atom as legs. The ruthenacycle is essentially coplanar with the imidazole ring of the NHC ligand, making a dihedral angle of 0.85 (8)°.

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水晶的学院——3——[3,5-bis (2,6-di-methyl-phen-yl) -1,2-phenyl-ene]达到华(2,6,2 " 6 " -tetra-methyl-1,1: 3 (" 1 " -ter-phen-yl-5 -yl) imidazol-2-yl-idene chlorido……-(η(6)-p-cymene钌(II) benzene disolvate .
标题化合物[Ru(C47H43N2)Cl(C10H14)]·2C6H6与两个独立的苯分子结晶。n -杂环碳(NHC)配体的一个n -芳基部分经过环金属化形成一个五元钌环。该复合物具有三脚钢琴凳结构,其中两个C原子合并在五元钌环中,一个Cl原子作为腿。钌环与NHC配体的咪唑环基本共面,形成0.85(8)°的二面角。
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期刊介绍: Acta Crystallographica Section E: Structure Reports Online is the IUCr highly popular open-access structural journal. It provides a simple and easily accessible publication mechanism for the growing number of inorganic, metal-organic and organic crystal structure determinations. The electronic submission, validation, refereeing and publication facilities of the journal ensure very rapid and high-quality publication, whilst key indicators and validation reports provide measures of structural reliability. In 2009, the journal published over 4000 structures. The average publication time is less than one month.
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