195Pt NMR and DFT computational methods as tools towards the understanding of speciation and hydration/solvation of [PtX6] 2- (X = Cl-, Br-) anions in solution

Date
2006
Authors
Koch K.R.
Burger M.R.
Kramer J.
Westra A.N.
Journal Title
Journal ISSN
Volume Title
Publisher
Abstract
195Pt NMR together with DFT calculations and MD simulations, offer a powerful toolkit with which to probe the hydration shells of the [PtCl6]2- anions, which may lead to a more profound understanding of the solute-solvent interactions of such complexes. © The Royal Society of Chemistry 2006.
Description
Keywords
Complexation, Computational methods, Computer simulation, Nuclear magnetic resonance spectroscopy, Probability density function, Solutions, Solvents, MD simulations, Powerful toolkit, Solute-solvent interactions, Platinum compounds
Citation
Dalton Transactions
27