Thermodynamics Research Center / ThermoML | Journal of Chemical and Engineering Data

Synthesis, Characterization, and Thermodynamic Study of Barium Benzoate Ba(C7H5O2)2(s)

Yang, W.-W.[Wei-Wei], Di, Y.-Y.[You-Ying], Kong, Y.-X.[Yu-Xia], Zhu, Y.-F.[Yan-Feng], Tan, Z.-C.[Zhi-Cheng]
J. Chem. Eng. Data 2009, 54, 7, 2038-2044
ABSTRACT
Benzoic acid and barium hydroxide octahydrate were used as reactants, and a compound Ba(C7H5O2)2(s) was synthesized by the method of hydrothermal reaction. Chemical and elemental analyses, FTIR, and X-ray powder diffraction techniques were applied to characterize the composition and structure of the compound. Low-temperature heat capacities of the compound were measured by a precision automated adiabatic calorimeter over the temperature range from (77 to 402) K. A polynomial equation of the heat capacities as a function of temperature was fitted by the least-squares method. Smoothed heat capacities and thermodynamic functions of the compound were calculated on the basis of the fitted polynomial. The enthalpy change of the reaction of benzoic acid with barium hydroxide octahydrate was determined to be (22.03 +- 0.30) kJ*mol-1 by respective measuring enthalpies of dissolution of benzoic acid and Ba(C7H5O2)2(s) in 0.1 mol*dm-3 HCl and barium hydroxide octahydrate in 0.1 mol*dm-3 HCl solution containing certain amounts of benzoic acid at 298.15 K by using an isoperibol solution-reaction calorimeter. The standard molar enthalpy of formation of the title compound Ba(C7H5O2)2(s) was derived to be -(1231.47 +- 1.12) kJ*mol-1 in accordance with Hess law.
Compounds
# Formula Name
1 Ba barium
2 H2 hydrogen
3 C graphite
4 O2 oxygen
5 C14H10BaO4 barium benzoate
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
  • 5
  • Molar heat capacity at constant pressure, J/K/mol ; Crystal
  • Temperature, K; Crystal
  • Pressure, kPa; Crystal
  • Crystal
  • Vacuum adiabatic calorimetry
  • 117
  • RXND
  • 5
  • 1
  • 2
  • 3
  • 4
  • Molar enthalpy of reaction, kJ/mol
  • Solution calorimetry
  • 1