title: Prediction of the vapor pressure and vaporization enthalpy of 1-n-alkyl-3-methylimidazolium-bis-(trifluoromethanesulfonyl) amide ionic liquids.
abstract: The vapor pressures and vaporization enthalpies of a series of 1-n-alkyl-3-methylimidazolium-bis-(trifluoromethanesulfonyl) amide ionic liquids have been predicted with two different approaches using the COSMO-RS method and quantum chemical gas phase calculations. While the calculated enthalpies are in good agreement with the experimental data, COSMO-RS seems to underestimate the vapor pressures by roughly 0.5-4 log units dependent on the IL and approach used.
authors: COSMOlogic GmbH & Co, KG Burscheider Strasse 515, 51381, Leverkusen, Germany. diedenhofen@cosmologic.de
authors: Michael
authors: M
authors: Diedenhofen
authors: Andreas
authors: A
authors: Klamt
authors: Kenneth
authors: K
authors: Marsh
authors: Ansgar
authors: A
authors: Schäfer