Molecule Viewer


Thermodynamics at 298.15 K and standard pressure


Enthalpy
PropertyValueUnit
Translational6.20kJ mol-1
Rotational3.72kJ mol-1
Vibrational177.55kJ mol-1
Total (Trans. + Rot. + Vib.)187.47kJ mol-1
Heat Capacity at Constant Pressure
PropertyValueUnit
Translational20.79J mol-1 K-1
Rotational12.47J mol-1 K-1
Vibrational132.30J mol-1 K-1
Total (Trans. + Rot. + Vib.)165.55J mol-1 K-1
Entropy
PropertyValueUnit
Translational174.05J mol-1 K-1
Rotational129.20J mol-1 K-1
Vibrational155.20J mol-1 K-1
Total (Trans. + Rot. + Vib.)458.44J mol-1 K-1
Other Properties
PropertyValueUnit
Heat of Formation-1316.31kJ mol-1

Molecular Orbitals


Vibrational Frequencies


Vibration
Vectors
Balls

Aqueous Solvation Energy at 298.15 K


Surface
Dipole
Translucent Molecule
PropertyValueUnit
Total Solvation Energy-52.52kJ mol-1
Polar Solvation Energy-69.94kJ mol-1
Nonpolar Solvation Energy17.43kJ mol-1
Surface Area150.01Å2
Charge of Molecule0
Dipole8.69Debye