Dual descriptor and molecular electrostatic potential: complementary tools for the study of the coordination chemistry of ambiphilic ligands
Author:
Affiliation:
1. Laboratoire des Sciences Analytiques
2. UMR CNRS 5280
3. Université Claude Bernard Lyon
4. 1 69622 Villeurbanne Cedex, France
5. Normandy University
6. COBRA UMR 6014 & FR 3038
7. Université de Rouen
8. INSA Rouen
9. CNRS
Abstract
The possibility to retrieve the coordinating properties of ligands by a combined dual descriptor and molecular electrostatic potential analysis is shown, yielding a potentially predictive tool of their ambiphilicity and selectivity.
Publisher
Royal Society of Chemistry (RSC)
Subject
Physical and Theoretical Chemistry,General Physics and Astronomy
Link
http://pubs.rsc.org/en/content/articlepdf/2014/CP/C4CP01613K
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