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Synthesis, structure and density functional study of the ansa-rhenocene complex [Re{(η-C5H4)CMe2(η-C5H4)}Cl]

Abstract:

The ansa-rhenocene compound [Re{(η-C5H4)CMe2(η-C5H4)}Cl] 1 has been prepared by reaction of ReCl5 with[K2(C5H4)CMe2(C5H4)]. X-Ray crystallography shows the molecular structure to be unsymmetrical, with the angle defined by the Re-bridgehead carbon vector and the chlorine atom found to be 170.4. A density functional study compares the electronic structure of [Re{(η-C5H4)CH2(η-C5H4)}Cl] with [Re{(η-C5H5)2Cl] and shows that for the ansa-bridged species, the chlorine binds less effectively in the...

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Publication status:
Published
Peer review status:
Peer reviewed

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Publisher copy:
10.1039/a908619f

Authors


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Institution:
University of Oxford
Oxford college:
Jesus College
Department:
Mathematical,Physical & Life Sciences Division - Chemistry - Inorganic Chemistry Laboratory
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Institution:
University of Oxford
Oxford college:
St John's College
Department:
Mathematical,Physical & Life Sciences Division - Chemistry - Inorganic Chemistry Laboratory
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Institution:
University of Oxford
Oxford college:
St Hugh's College
Department:
Mathematical,Physical & Life Sciences Division - Chemistry - Inorganic Chemistry Laboratory
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Institution:
University of Oxford
Oxford college:
St Catherine's College
Department:
Mathematical,Physical & Life Sciences Division - Chemistry - Inorganic Chemistry Laboratory
More by this author
Institution:
University of Oxford
Department:
Mathematical,Physical & Life Sciences Division - Chemistry - Inorganic Chemistry Laboratory
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Journal:
Journal of the Chemical Society - Dalton Transactions Journal website
Issue:
3
Pages:
329-333
Publication date:
2000
DOI:
EISSN:
1477-9234
ISSN:
1477-9226
URN:
uuid:d9bf5515-2922-4c96-b245-62367f3de4e9
Local pid:
ora:2667

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