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[1,2-双(二苯基膦基)乙烷-κP,P']{2-[(4-硝基苯甲酰基甲基)二苯基膦基]苯基-κC,C'}钯(II)三氟甲磺酸酯-二氯甲烷-正己烷(1/1/0.5)

[1,2-Bis(diphenyl-phosphan-yl)ethane-κP,P']{2-[(4-nitro-benzoyl-meth-yl)diphenyl-phosphan-yl]phenyl-κC,C'}palladium(II) trifluoro-methane-sulfonate-dichloro-methane-n-hexane (1/1/0.5).

作者信息

Rizzoli Corrado, Karami Kazem, Borzooie Farzaneh

出版信息

Acta Crystallogr Sect E Struct Rep Online. 2011 Apr 1;67(Pt 4):m416-7. doi: 10.1107/S1600536811008075. Epub 2011 Mar 9.

Abstract

In the cation of the title compound, [Pd(C(26)H(19)NO(3)P)(C(26)H(24)P(2))]CF(3)O(3)S·CH(2)Cl(2)·0.5C(6)H(14), the Pd(II) atom has a slightly tetra-hedrally distorted square-planar coordination geometry. The PdC(3)P and PdC(2)P(2) five-membered metallacycles adopt envelope and twist conformations, respectively. In the crystal, inter-molecular C-H⋯O hydrogen bonds link cations and anions into a three-dimensional network. The dichloro-methane solvent mol-ecule is disordered over three orientations with a site-occupancy ratio of 0.5/0.3/0.2. The n-hexane solvent mol-ecule has a crystallographically imposed centre of symmetry.

摘要

在标题化合物[Pd(C₂₆H₁₉NO₃P)(C₂₆H₂₄P₂)]CF₃O₃S·CH₂Cl₂·0.5C₆H₁₄的阳离子中,Pd(II)原子具有轻微四面体畸变的平面正方形配位几何结构。PdC₃P和PdC₂P₂五元金属环分别采用信封式和扭曲构象。在晶体中,分子间C—H⋯O氢键将阳离子和阴离子连接成三维网络。二氯甲烷溶剂分子在三个取向上无序,占位比为0.5/0.3/0.2。正己烷溶剂分子具有晶体学上施加的对称中心。

https://cdn.ncbi.nlm.nih.gov/pmc/blobs/708f/3099852/3a5245bcf9e8/e-67-0m416-fig1.jpg

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