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四甲基(苯乙基)环戊二烯基钼三羰基二聚体的晶体结构

Crystal structure of the tetra-meth-yl(pheneth-yl)cyclo-penta-dienylmolybdenumtricarbonyl dimer.

作者信息

Brown Loren, Marron Danny, Smith Casey, Merola Joseph

机构信息

Virginia Tech, Dept. of Chemistry 0212, Blacksburg, VA, 24060, USA.

出版信息

Acta Crystallogr E Crystallogr Commun. 2018 Jun 26;74(Pt 7):1017-1020. doi: 10.1107/S2056989018008885. eCollection 2018 Jul 1.

DOI:10.1107/S2056989018008885
PMID:30002907
原文链接:https://pmc.ncbi.nlm.nih.gov/articles/PMC6038615/
Abstract

The structure of the dimer bis-{tricarbon-yl[η-tetra-meth-yl(pheneth-yl)cyclo-penta-dien-yl]molybdenum}(-), [Mo(CH)(CO)], at 102 K has triclinic ( ) symmetry. The reaction between tetra-meth-yl(pheneth-yl)cyclo-penta-diene and molybdenum hexa-carbonyl in refluxing xylenes for 18 h led to a 56% yield of the dimer as a red solid. The asymmetric unit of the structure is the tetra-meth-yl(pheneth-yl)cyclo-penta-dienylmolybdenumtricarbonyl moiety and the entire dimeric mol-ecule is generated by inversion symmetry. The Mo-Mo bond length is 3.2773 (3) Å, a value slightly above the mean value for all [CpMo(CO)] compounds listed in the CSD and slightly below the mean for [Cp*Mo(CO)] complexes.

摘要

二聚体双-{三羰基[η-四甲基(苯乙基)环戊二烯基]钼}(-),即[Mo(CH)(CO)],在102 K时具有三斜晶系( )对称性。四甲基(苯乙基)环戊二烯与六羰基钼在回流二甲苯中反应18小时,得到二聚体,产率为56%,为红色固体。该结构的不对称单元是四甲基(苯乙基)环戊二烯基钼三羰基部分,整个二聚体分子由反演对称性生成。Mo-Mo键长为3.2773(3) Å,该值略高于剑桥晶体结构数据库(CSD)中列出的所有[CpMo(CO)]化合物的平均值,略低于[Cp*Mo(CO)]配合物的平均值。

https://cdn.ncbi.nlm.nih.gov/pmc/blobs/fa2c/6038615/f12ab26d4fe0/e-74-01017-fig2.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/fa2c/6038615/43b21bc659fa/e-74-01017-fig1.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/fa2c/6038615/f12ab26d4fe0/e-74-01017-fig2.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/fa2c/6038615/43b21bc659fa/e-74-01017-fig1.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/fa2c/6038615/f12ab26d4fe0/e-74-01017-fig2.jpg

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