(z)-3-hydroxyprop-2-enal

Molecule Viewer


Thermodynamics at 298.15 K and standard pressure


Enthalpy
PropertyValueUnit
Translational6.20kJ mol-1
Rotational3.72kJ mol-1
Vibrational179.42kJ mol-1
Total (Trans. + Rot. + Vib.)189.34kJ mol-1
Heat Capacity at Constant Pressure
PropertyValueUnit
Translational20.79J mol-1 K-1
Rotational12.47J mol-1 K-1
Vibrational49.75J mol-1 K-1
Total (Trans. + Rot. + Vib.)83.01J mol-1 K-1
Entropy
PropertyValueUnit
Translational162.09J mol-1 K-1
Rotational105.75J mol-1 K-1
Vibrational47.00J mol-1 K-1
Total (Trans. + Rot. + Vib.)314.83J mol-1 K-1
Other Properties
PropertyValueUnit
Heat of Formation-258.35kJ mol-1

Molecular Orbitals


Aqueous Solvation Energy at 298.15 K


Surface
Dipole
Translucent Molecule
PropertyValueUnit
Total Solvation Energy-23.37kJ mol-1
Polar Solvation Energy-32.85kJ mol-1
Nonpolar Solvation Energy9.49kJ mol-1
Surface Area85.97Å2
Charge of Molecule0
Dipole4.89Debye