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Structural studies of cyclic ureas: 2. Enthalpy of formation of parabanic acid
Authors:Maria das Dores MC Ribeiro da Silva  Manuel AV Ribeiro da Silva  Vera LS Freitas  Maria Victoria Roux  Pilar Jimnez  Juan Z Dvalos  Pilar Cabildo  Rosa M Claramunt  Jos Elguero
Institution:Maria das Dores M.C. Ribeiro da Silva, Manuel A.V. Ribeiro da Silva, Vera L.S. Freitas, Maria Victoria Roux, Pilar Jiménez, Juan Z. Dávalos, Pilar Cabildo, Rosa M. Claramunt,José Elguero
Abstract:Thermophysical and thermochemical studies have been carried out for crystalline parabanic acid. The thermophysical study was made by differential scanning calorimetry, DSC, over the temperature interval between T = (263 and 473) K. Two phase transitions were found: at T = (392.3 ± 1.6) K with the enthalpy of transition of (2.1 ± 0.4) kJ · mol−1 and at T = (509.8 ± 1.5) K, when the compound was scanned to its fusion temperature. The standard (pring operator = 0.1 MPa) molar enthalpy of formation, at T = 298.15 K, for crystalline parabanic acid was determined using static-bomb combustion calorimetry as −(590.2 ± 1.0) kJ · mol−1. The standard molar enthalpy of sublimation, at T = 298.15 K, was derived from the variation of their vapour pressures, measured by the Knudsen-effusion method, with the temperature. These two thermochemical parameters yielded the standard molar enthalpy of formation in the gaseous phase, at T = 298.15 K, as −(470.8 ± 1.2) kJ · mol−1.
Keywords:Enthalpy of combustion  Enthalpy of sublimation  Enthalpy of formation  Parabanic acid  Combustion calorimetry  Knudsen effusion  Differential scanning calorimetry  Vapour pressure  Entropy of sublimation  Gibbs free energy of sublimation  Heat capacities  G-3 calculations
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