Thermodynamics Research Center / ThermoML | Journal of Chemical Thermodynamics

Investigation of solute-solvent interactions in {1-butyl-3-methyl imidazoliumBis(trifluoromethylsulfonyl)imide + dimethylcarbonate} mixture using physicochemical properties

Rao, V. S.[V. Srinivasa], Reddy, M. S.[M. Srinivasa], Nayeem, S. M.[Sk. Md], Raju, K. T. S. S.[K. Thomas S.S.], Krishna, K. B. M.[K. Bala Murali], Babu, B. H.[B. Hari]
J. Chem. Thermodyn. 2017, 115, 133-147
ABSTRACT
Physical properties, such as density (q), speed of sound (u) and refractive index of [Bmim][NTf2], DMC and their binary mixtures are measured over the whole composition range as a function of temperature between (303.15 and 323.15) K at atmospheric pressure. Experimental values are used to calculate excess values of molar volumes (VE m)/partial molar volumes (VE m)/partial molar volumes at infinite dilution (VE;1 m )/isentropic compressibility (jEs )/free length (LEf ), speed of sound (uE) and isobaric thermal expansion coefficient (aEP ) for the binary mixture. These excess properties are fitted to the Redlich-Kister equation to obtain the binary coefficients and the standard deviations. A qualitative analysis of these parameters indicates strong intermolecular interactions and the interaction increases with the increase in temperature. Further, through physicochemical properties, an attempt for calorimetric excess chemical potential using different equations is computed at T = 308.15 K. The present investigation also comprises of evaluation of the acoustic non-linearity parameter (B/A) in the mixtures and calculation of cohesive energy (DA), Van der Wall s constants (a, b), distance of closest approach (d). The presence of strong interactions is further supported by IR spectroscopy and the Prigogine Flory Patterson (PFP) theory.
Compounds
# Formula Name
1 C10H15F6N3O4S2 1-butyl-3-methylimidazolium bis(trifluoromethylsulfonyl)imide
2 C3H6O3 dimethyl carbonate
Datasets
The table above is generated from the ThermoML associated json file (link above). POMD and RXND refer to PureOrMixture and Reaction Datasets. The compound numbers are included in properties, variables, and phases, if specificied; the numbers refer to the table of compounds on the left.
Type Compound-# Property Variable Constraint Phase Method #Points
  • POMD
  • 1
  • Mass density, kg/m3 ; Liquid
  • Temperature, K; Liquid
  • Pressure, kPa; Liquid
  • Liquid
  • Vibrating tube method
  • 5
  • POMD
  • 1
  • Speed of sound, m/s ; Liquid
  • Temperature, K; Liquid
  • Pressure, kPa; Liquid
  • Frequency, MHz; Liquid
  • Liquid
  • Single path-length method
  • 5
  • POMD
  • 1
  • Refractive index (Na D-line) ; Liquid
  • Temperature, K; Liquid
  • Pressure, kPa; Liquid
  • Liquid
  • Standard Abbe refractometry
  • 5
  • POMD
  • 2
  • Mass density, kg/m3 ; Liquid
  • Temperature, K; Liquid
  • Pressure, kPa; Liquid
  • Liquid
  • Vibrating tube method
  • 5
  • POMD
  • 2
  • Speed of sound, m/s ; Liquid
  • Temperature, K; Liquid
  • Pressure, kPa; Liquid
  • Frequency, MHz; Liquid
  • Liquid
  • Single path-length method
  • 5
  • POMD
  • 2
  • Refractive index (Na D-line) ; Liquid
  • Temperature, K; Liquid
  • Pressure, kPa; Liquid
  • Liquid
  • Standard Abbe refractometry
  • 5
  • POMD
  • 1
  • 2
  • Mass density, kg/m3 ; Liquid
  • Temperature, K; Liquid
  • Mole fraction - 1; Liquid
  • Pressure, kPa; Liquid
  • Liquid
  • Vibrating tube method
  • 75
  • POMD
  • 1
  • 2
  • Speed of sound, m/s ; Liquid
  • Temperature, K; Liquid
  • Mole fraction - 1; Liquid
  • Pressure, kPa; Liquid
  • Frequency, MHz; Liquid
  • Liquid
  • Single path-length method
  • 75
  • POMD
  • 1
  • 2
  • Refractive index (Na D-line) ; Liquid
  • Temperature, K; Liquid
  • Mole fraction - 1; Liquid
  • Pressure, kPa; Liquid
  • Liquid
  • Standard Abbe refractometry
  • 75