DOI: 10.1039/d6cp02253g ISSN: 1463-9076
COSMO-RS-based theoretical investigation of equilibria in protic ionic liquids
Kevin Breitwieser, Olesia Belova, Ilkka Kilpeläinen, Vladimir AseyevCOSMO-PIL aids in the theoretical analysis of the composition of protic ionic liquids. It demonstrates the influence of acid/base ratios and residual water on ionic liquid composition and helps understand the reported poor ionicity.