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- W3150941781 endingPage "115925" @default.
- W3150941781 startingPage "115925" @default.
- W3150941781 abstract "The properties of N-methyl-2-pyrrolidonium hydrogen sulfate mixed with alkanols are studied as a function of mixtures composition and temperature. Experimental physicochemical properties combined with molecular simulation (quantum chemistry and classical molecular dynamics) were considered, thus providing a micro and macroscopic characterization of fluids' structuring, intermolecular forces and molecular aggregation. The results were analyzed in thermodynamics terms considering deviations of ideality and mixing properties as well as from the coordination and interaction between the involved ions and molecules by the developed complex hydrogen bonding networks. The results allow a multiscale characterization of the considered mixed systems thus providing the required information for the possible applications of low viscous protic pyrrolidonium-based ionic liquids and their mixtures with relevant hydrogen bonding molecular cosolvents." @default.
- W3150941781 created "2021-04-13" @default.
- W3150941781 creator A5024738927 @default.
- W3150941781 creator A5050139945 @default.
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- W3150941781 creator A5058281977 @default.
- W3150941781 creator A5068294694 @default.
- W3150941781 creator A5075364003 @default.
- W3150941781 date "2021-07-01" @default.
- W3150941781 modified "2023-09-25" @default.
- W3150941781 title "On the properties of N-methyl-2-pyrrolidonium hydrogen sulfate ionic liquid and alkanol mixtures" @default.
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- W3150941781 doi "https://doi.org/10.1016/j.molliq.2021.115925" @default.