Computational studies on the mechanism of the gold(i)-catalysed rearrangement of cyclopropenes†
Abstract
Density functional theory calculations have been employed to investigate the mechanism of gold(I)-catalysed rearrangements of
* Corresponding authors
a
School of Engineering and Physical Sciences, Chemistry – William H. Perkin Building, Heriot-Watt University, Edinburgh EH14 4AS, UK
E-mail:
A.Lee@hw.ac.uk, S.A.Macgregor@hw.ac.uk
Tel: +44(0)131-4518030/+44(0) 131 451 8031
Density functional theory calculations have been employed to investigate the mechanism of gold(I)-catalysed rearrangements of
M. S. Hadfield, L. J. L. Häller, A. Lee, S. A. Macgregor, J. A. T. O'Neill and A. M. Watson, Org. Biomol. Chem., 2012, 10, 4433 DOI: 10.1039/C2OB25183C
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