Synthesis of a Trigold Monocation: An Isolobal Analogue of [H sub(3)] super(+)

Isolobal and isolatable: A triangular [L sub(3)Au sub(3)] super(+ ) ion, bearing N-heterocyclic carbene ligands (L), is crystallographically characterized (see structure; Auyellow, Cgray, Nblue). Density functional theory suggests full valence delocalization among the gold atoms, with the HOMO compo...

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Veröffentlicht in:Angewandte Chemie International Edition 2012-11, Vol.51 (48), p.12077-12080
Hauptverfasser: Robilotto, Thomas J, Bacsa, John, Gray, Thomas G, Sadighi, Joseph P
Format: Artikel
Sprache:eng
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Zusammenfassung:Isolobal and isolatable: A triangular [L sub(3)Au sub(3)] super(+ ) ion, bearing N-heterocyclic carbene ligands (L), is crystallographically characterized (see structure; Auyellow, Cgray, Nblue). Density functional theory suggests full valence delocalization among the gold atoms, with the HOMO composed largely of gold 6s orbitals and the LUMO comprising a degenerate pair. This orbital picture is analogous to that of [H sub(3)] super(+).
ISSN:1433-7851
1521-3773
DOI:10.1002/anie.201206712