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The gold(iii)–CO bond: a missing piece in the gold carbonyl complex landscape†
Carlo Alberto Gaggioli,Leonardo Belpassi
Chemical Communications Pub Date : 01/11/2017 00:00:00 , DOI:10.1039/C6CC09879G
Abstract

We investigate the Au(III)–CO bond in the [(CNC)Au(III)CO]+ complex via charge-displacement (CD) analysis, revealing surprising peculiarities with respect to the Au(I)–CO bond. It shows a large Au(III) ← CO σ donation and, unexpectedly, an even larger Au(III) → CO π back-donation. The overall bonding picture, including a marked anisotropy in the Au(III) → CO in-plane and out-of-plane π back-donation components, is consistent with a CO carbon atom highly susceptible to nucleophilic attack.

Graphical abstract: The gold(iii)–CO bond: a missing piece in the gold carbonyl complex landscape
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