Thermodynamics Research Center / ThermoML | Fluid Phase Equilibria

Ionic solvation of tetrabutylammonium hexafluorophosphate in pure nitromethane, 1, 3-dioxolane and nitrobenzene: A comparative physicochemical study

Roy, Mahendra Nath, Ekka, Deepak, Dewan, Rajani
Fluid Phase Equilib. 2012, 314, 113-120
ABSTRACT
Electrolytic conductivities, densities, viscosities, refractive indices and speed of sound of tetrabutylammonium hexafluorophosphate (Bu4NPF6) have been studied in nitromethane (NM), 1,3-dioxolane (DO) and nitrobenzene (NB) at 298.15 K. The limiting molar conductivities, association constants, and the distance of closest approach of the ion have been evaluated using the Fuoss conductance equation (1978). The Walden product is obtained and discussed. The deviation of the conductmetric curves from linearity for the salt in 1,3-dioxolane indicates triple-ion formation, and therefore the corresponding conductance data have been analysed by using the Fuoss-Kraus theory of triple-ions. The limiting apparent molar volumes, experimental slopes derived from the Masson equation, and viscosity A and B coefficients using the Jones-Dole equation have been interpreted in terms of ion-ion and ion-solvent interactions, respectively. Molar refraction have been calculated using the Lorentz-Lorenz equation. The adiabatic compressibility have been evaluated using the speed of sound values. There after, the limiting apparent molar adiabatic compressibility have been calculated and discussed.
Compounds
# Formula Name
1 C16H36F6NP tetrabutylammonium hexafluorophosphate
2 CH3NO2 nitromethane
3 C3H6O2 1,3-dioxolane
4 C6H5NO2 nitrobenzene
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
  • 2
  • Mass density, kg/m3 ; Liquid
  • Pressure, kPa; Liquid
  • Temperature, K; Liquid
  • Liquid
  • Vibrating tube method
  • 1
  • POMD
  • 2
  • Viscosity, Pa*s ; Liquid
  • Pressure, kPa; Liquid
  • Temperature, K; Liquid
  • Liquid
  • Capillary tube (Ostwald; Ubbelohde) method
  • 1
  • POMD
  • 2
  • Refractive index (other wavelength) ; Liquid
  • Pressure, kPa; Liquid
  • Temperature, K; Liquid
  • Wavelength, nm; Liquid
  • Liquid
  • Standard Abbe refractometry
  • 1
  • POMD
  • 2
  • Speed of sound, m/s ; Liquid
  • Pressure, kPa; Liquid
  • Temperature, K; Liquid
  • Liquid
  • Fixed Frequency Variable Path Interferometer
  • 1
  • POMD
  • 3
  • Mass density, kg/m3 ; Liquid
  • Pressure, kPa; Liquid
  • Temperature, K; Liquid
  • Liquid
  • Vibrating tube method
  • 1
  • POMD
  • 3
  • Viscosity, Pa*s ; Liquid
  • Pressure, kPa; Liquid
  • Temperature, K; Liquid
  • Liquid
  • Capillary tube (Ostwald; Ubbelohde) method
  • 1
  • POMD
  • 3
  • Refractive index (other wavelength) ; Liquid
  • Pressure, kPa; Liquid
  • Temperature, K; Liquid
  • Wavelength, nm; Liquid
  • Liquid
  • Standard Abbe refractometry
  • 1
  • POMD
  • 3
  • Speed of sound, m/s ; Liquid
  • Pressure, kPa; Liquid
  • Temperature, K; Liquid
  • Liquid
  • Fixed Frequency Variable Path Interferometer
  • 1
  • POMD
  • 4
  • Mass density, kg/m3 ; Liquid
  • Pressure, kPa; Liquid
  • Temperature, K; Liquid
  • Liquid
  • Vibrating tube method
  • 1
  • POMD
  • 4
  • Viscosity, Pa*s ; Liquid
  • Pressure, kPa; Liquid
  • Temperature, K; Liquid
  • Liquid
  • Capillary tube (Ostwald; Ubbelohde) method
  • 1
  • POMD
  • 4
  • Refractive index (other wavelength) ; Liquid
  • Pressure, kPa; Liquid
  • Temperature, K; Liquid
  • Wavelength, nm; Liquid
  • Liquid
  • Standard Abbe refractometry
  • 1
  • POMD
  • 4
  • Speed of sound, m/s ; Liquid
  • Pressure, kPa; Liquid
  • Temperature, K; Liquid
  • Liquid
  • Fixed Frequency Variable Path Interferometer
  • 1
  • POMD
  • 2
  • 1
  • Mass density, kg/m3 ; Liquid
  • Amount concentration (molarity), mol/dm3 - 1; Liquid
  • Pressure, kPa; Liquid
  • Temperature, K; Liquid
  • Liquid
  • Vibrating tube method
  • 7
  • POMD
  • 2
  • 1
  • Viscosity, Pa*s ; Liquid
  • Amount concentration (molarity), mol/dm3 - 1; Liquid
  • Pressure, kPa; Liquid
  • Temperature, K; Liquid
  • Liquid
  • Capillary tube (Ostwald; Ubbelohde) method
  • 7
  • POMD
  • 2
  • 1
  • Molar conductivity, S*m2/mol ; Liquid
  • Amount concentration (molarity), mol/dm3 - 1; Liquid
  • Pressure, kPa; Liquid
  • Temperature, K; Liquid
  • Liquid
  • Alternating current cell with electrodes
  • 15
  • POMD
  • 2
  • 1
  • Refractive index (other wavelength) ; Liquid
  • Amount concentration (molarity), mol/dm3 - 1; Liquid
  • Pressure, kPa; Liquid
  • Temperature, K; Liquid
  • Wavelength, nm; Liquid
  • Liquid
  • Standard Abbe refractometry
  • 7
  • POMD
  • 2
  • 1
  • Speed of sound, m/s ; Liquid
  • Amount concentration (molarity), mol/dm3 - 1; Liquid
  • Pressure, kPa; Liquid
  • Temperature, K; Liquid
  • Liquid
  • Fixed Frequency Variable Path Interferometer
  • 7
  • POMD
  • 3
  • 1
  • Mass density, kg/m3 ; Liquid
  • Amount concentration (molarity), mol/dm3 - 1; Liquid
  • Pressure, kPa; Liquid
  • Temperature, K; Liquid
  • Liquid
  • Vibrating tube method
  • 7
  • POMD
  • 3
  • 1
  • Viscosity, Pa*s ; Liquid
  • Amount concentration (molarity), mol/dm3 - 1; Liquid
  • Pressure, kPa; Liquid
  • Temperature, K; Liquid
  • Liquid
  • Capillary tube (Ostwald; Ubbelohde) method
  • 7
  • POMD
  • 3
  • 1
  • Molar conductivity, S*m2/mol ; Liquid
  • Amount concentration (molarity), mol/dm3 - 1; Liquid
  • Pressure, kPa; Liquid
  • Temperature, K; Liquid
  • Liquid
  • Alternating current cell with electrodes
  • 15
  • POMD
  • 3
  • 1
  • Refractive index (other wavelength) ; Liquid
  • Amount concentration (molarity), mol/dm3 - 1; Liquid
  • Pressure, kPa; Liquid
  • Temperature, K; Liquid
  • Wavelength, nm; Liquid
  • Liquid
  • Standard Abbe refractometry
  • 7
  • POMD
  • 3
  • 1
  • Speed of sound, m/s ; Liquid
  • Amount concentration (molarity), mol/dm3 - 1; Liquid
  • Pressure, kPa; Liquid
  • Temperature, K; Liquid
  • Liquid
  • Fixed Frequency Variable Path Interferometer
  • 7
  • POMD
  • 4
  • 1
  • Mass density, kg/m3 ; Liquid
  • Amount concentration (molarity), mol/dm3 - 1; Liquid
  • Pressure, kPa; Liquid
  • Temperature, K; Liquid
  • Liquid
  • Vibrating tube method
  • 7
  • POMD
  • 4
  • 1
  • Viscosity, Pa*s ; Liquid
  • Amount concentration (molarity), mol/dm3 - 1; Liquid
  • Pressure, kPa; Liquid
  • Temperature, K; Liquid
  • Liquid
  • Capillary tube (Ostwald; Ubbelohde) method
  • 7
  • POMD
  • 4
  • 1
  • Molar conductivity, S*m2/mol ; Liquid
  • Amount concentration (molarity), mol/dm3 - 1; Liquid
  • Pressure, kPa; Liquid
  • Temperature, K; Liquid
  • Liquid
  • Alternating current cell with electrodes
  • 15
  • POMD
  • 4
  • 1
  • Refractive index (other wavelength) ; Liquid
  • Amount concentration (molarity), mol/dm3 - 1; Liquid
  • Pressure, kPa; Liquid
  • Temperature, K; Liquid
  • Wavelength, nm; Liquid
  • Liquid
  • Standard Abbe refractometry
  • 7
  • POMD
  • 4
  • 1
  • Speed of sound, m/s ; Liquid
  • Amount concentration (molarity), mol/dm3 - 1; Liquid
  • Pressure, kPa; Liquid
  • Temperature, K; Liquid
  • Liquid
  • Fixed Frequency Variable Path Interferometer
  • 7