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
dc.contributor.author | Koch K.R. | |
dc.contributor.author | Burger M.R. | |
dc.contributor.author | Kramer J. | |
dc.contributor.author | Westra A.N. | |
dc.date.accessioned | 2011-05-15T15:59:06Z | |
dc.date.available | 2011-05-15T15:59:06Z | |
dc.date.issued | 2006 | |
dc.description.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. | |
dc.description.version | Article | |
dc.identifier.citation | Dalton Transactions | |
dc.identifier.citation | 27 | |
dc.identifier.issn | 14779226 | |
dc.identifier.other | 10.1039/b605182k | |
dc.identifier.uri | http://hdl.handle.net/10019.1/11006 | |
dc.subject | Complexation | |
dc.subject | Computational methods | |
dc.subject | Computer simulation | |
dc.subject | Nuclear magnetic resonance spectroscopy | |
dc.subject | Probability density function | |
dc.subject | Solutions | |
dc.subject | Solvents | |
dc.subject | MD simulations | |
dc.subject | Powerful toolkit | |
dc.subject | Solute-solvent interactions | |
dc.subject | Platinum compounds | |
dc.title | 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 | |
dc.type | Article |