Supramolecular Interactions of Cryptates in Concentrated Solutions: The Effect of Solvent and Counterions Investigated by MD Simulations

We present a molecular dynamics study of concentrated solutions of K + ⊂222 cryptates, comparing two counterions X − (Chloride Cl − versus Picrate Pic − ) and three solvents (water, acetonitrile, and chloroform), with the main aim to investigate the distribution of the ions in the different solution...

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Bibliographic Details
Published in:Solvent extraction and ion exchange Vol. 25; no. 2; pp. 257 - 271
Main Authors: Jost, P., Galand, N., Schurhammer, R., Wipff, G.
Format: Journal Article
Language:English
Published: Taylor & Francis Group 01-03-2007
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