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Experimental and quantum chemical studies of anionic analogues of N-heterocyclic carbenes.

Abstract:

A combination of quantum chemical and synthetic/crystallographic methods have been employed to probe electronic structure in two series of anionic ligands related to the well known N-heterocyclic carbene (NHC) class of donor. Analyses of (i) the respective frontier orbital energies/compositions for the 'free' ligands and the results of ETS-NOCV studies of the bonding in model group 11 complexes; and (ii) the structural metrics for (new) linear gold(i) compounds, have been used to probe the bo...

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Publication status:
Published
Peer review status:
Peer reviewed
Version:
Accepted Manuscript

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Publisher copy:
10.1039/c8dt01661e

Authors


More by this author
Institution:
University of Oxford
Division:
MPLS Division
Department:
Chemistry
Role:
Author
More by this author
Institution:
University of Oxford
Division:
MPLS Division
Department:
Chemistry
Role:
Author
More by this author
Institution:
University of Oxford
Division:
MPLS Division
Department:
Chemistry
Role:
Author
More by this author
Institution:
University of Oxford
Division:
MPLS Division
Department:
Chemistry
Role:
Author
More by this author
Institution:
University of Oxford
Division:
MPLS Division
Department:
Chemistry
Role:
Author
Expand authors...
Publisher:
Royal Society of Chemistry Publisher's website
Journal:
Dalton Transactions Journal website
Volume:
47
Issue:
22
Pages:
7445-7455
Publication date:
2018-05-11
Acceptance date:
2018-05-09
DOI:
EISSN:
1477-9234
ISSN:
1477-9226
Pubs id:
pubs:854338
URN:
uri:bca981c6-eb5a-4ce9-90ff-5e42c684757d
UUID:
uuid:bca981c6-eb5a-4ce9-90ff-5e42c684757d
Local pid:
pubs:854338
Language:
English

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