Bonding in bis(pentalene)dimolybdenum:: Density functional calculations on Mo2(C8H6)2 and photoelectron spectroscopy of Mo2(C8H4(1,4-SiPri3)2)2

被引：32

作者：

Cloke, FGN

Green, JC

Jardine, CN

Kuchta, MC

机构：

[1] Univ Oxford, Inorgan Chem Lab, Oxford OX1 3QR, England

[2] Univ Sussex, Chem Lab, Brighton BN1 9QJ, E Sussex, England

来源：

ORGANOMETALLICS | 1999年 / 18卷 / 06期

关键词：

D O I：

10.1021/om980792u

中图分类号：

O61 [无机化学];

学科分类号：

070301 ; 081704 ;

摘要：

He I and He II photoelectron spectra are reported for Mo-2[C8H4(1,4-SiPr3i)(2)](2). Density functional calculations on the model compound Mo-2(C8H6)(2) give a structure with bond lengths and ionization energies in good agreement with those found for Mo-2[C8H4(1,4-SiPr3i)(2)](2) Fragment analysis of the bonding in Mo-2(C8H6)(2) indicates a double bond between the two Mo atoms. The bonding to the pentalene ligands is very covalent and resembles that found for simple metallocenes.

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页码：1087 / 1090

页数：4

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