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Electronic structure of strained silicon- and sulfur-bridged [1]ferrocenophanes and an analogous dicarbon-bridged [2]ferrocenophane: An investigation by photoelectron spectroscopy and density-functional theory

Abstract:

He I and He II photoelectron (PE) spectra of [Fe(η-C2H4)2SiMe2] (1), [Fe(η-C5H3Me)2SiMe2] (2), [Fe(η-C5H4)(η-C5Me 4)SiMe2] (3), [Fe(η-C5Me4)2SiMe2] (4), [Fe(η-C5H4)2C2H4] (5), and [Fe-(η-C5H4)2S] (6) have been measured and assigned. The d bands of 1-5 show less structure than that of ferrocene, consistent with a loss of degeneracy of the e2 orbitale on bending. Compound 6, which has the largest inter-ring angle of the series, shows two separate d bands. The trend in the first ionization energ...

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Publication status:
Published

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Publisher copy:
10.1021/om980087l

Authors


Drewitt, MJ More by this author
Dijkstra, T More by this author
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Institution:
University of Oxford
Department:
Oxford, MPLS, Chemistry, Inorganic Chemistry
More by this author
Institution:
University of Oxford
Department:
Oxford, MPLS, Chemistry, Inorganic Chemistry
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Journal:
ORGANOMETALLICS
Volume:
17
Issue:
10
Pages:
2113-2120
Publication date:
1998-05-11
DOI:
EISSN:
1520-6041
ISSN:
0276-7333
URN:
uuid:28df10ea-6708-4e70-8c64-a41414c0138b
Source identifiers:
94203
Local pid:
pubs:94203
Language:
English

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