Thermodynamics Research Center / ThermoML | Thermochimica Acta

Molar excess enthalpies and molar excess volumes of formamide + 1-propanol or 2-propanol and thermodynamic modeling by Prigogine-Flory-Patterson theory and Treszczanowicz-Benson association model

Rani, M.[Manju], Maken, S.[Sanjeev]
Thermochim. Acta 2013, 559, 98-106
ABSTRACT
Molar excess enthalpies ( ) at 298.15 K and 308.15 K and molar excess volumes ( ) at 308.15 K for formamide (1) + 1-propanol or 2-propanol (2) mixtures have been measured over the entire composition range. The excess enthalpies and excess volumes data have been utilized to study the thermodynamics of molecular interactions in terms of Prigogine-Flory-Patterson theory and Treszczanowicz-Benson association model with a Flory contribution term. In this paper, this Treszczanowicz-Benson association model was applied, for the first time, to binary mixtures containing both components associated (propanol and formamide) through hydrogen bonding. In both the cases, when either of formamide or propanol was assumed to be associated, the calculated and values compared well with corresponding experimental data. Extent of inter-molecular H-bonding in formamide and propanols in their binary mixtures was also reflected in their molar enthalpy of association of H-bonding and association constant .
Compounds
# Formula Name
1 CH3NO formamide
2 C3H8O propan-1-ol
3 C3H8O propan-2-ol
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
  • Refractive index (Na D-line) ; Liquid
  • Temperature, K; Liquid
  • Pressure, kPa; Liquid
  • Liquid
  • Standard Abbe refractometry
  • 1
  • POMD
  • 1
  • Mass density, kg/m3 ; Liquid
  • Temperature, K; Liquid
  • Pressure, kPa; Liquid
  • Liquid
  • Pycnometric method
  • 2
  • POMD
  • 2
  • Refractive index (Na D-line) ; Liquid
  • Temperature, K; Liquid
  • Pressure, kPa; Liquid
  • Liquid
  • Standard Abbe refractometry
  • 1
  • POMD
  • 2
  • Mass density, kg/m3 ; Liquid
  • Temperature, K; Liquid
  • Pressure, kPa; Liquid
  • Liquid
  • Pycnometric method
  • 2
  • POMD
  • 3
  • Refractive index (Na D-line) ; Liquid
  • Temperature, K; Liquid
  • Pressure, kPa; Liquid
  • Liquid
  • Standard Abbe refractometry
  • 1
  • POMD
  • 3
  • Mass density, kg/m3 ; Liquid
  • Temperature, K; Liquid
  • Pressure, kPa; Liquid
  • Liquid
  • Pycnometric method
  • 2
  • POMD
  • 2
  • 1
  • Excess molar volume, m3/mol ; Liquid
  • Mole fraction - 1; Liquid
  • Temperature, K; Liquid
  • Pressure, kPa; Liquid
  • Liquid
  • Direct dilatometry
  • 22
  • POMD
  • 2
  • 1
  • Excess molar enthalpy (molar enthalpy of mixing), kJ/mol ; Liquid
  • Temperature, K; Liquid
  • Mole fraction - 1; Liquid
  • Pressure, kPa; Liquid
  • Liquid
  • Flow calorimetry
  • 44
  • POMD
  • 3
  • 1
  • Excess molar volume, m3/mol ; Liquid
  • Mole fraction - 1; Liquid
  • Temperature, K; Liquid
  • Pressure, kPa; Liquid
  • Liquid
  • Direct dilatometry
  • 22
  • POMD
  • 3
  • 1
  • Excess molar enthalpy (molar enthalpy of mixing), kJ/mol ; Liquid
  • Temperature, K; Liquid
  • Mole fraction - 1; Liquid
  • Pressure, kPa; Liquid
  • Liquid
  • Flow calorimetry
  • 44