Molecule Viewer


Thermodynamics at 298.15 K and standard pressure


Enthalpy
PropertyValueUnit
Translational6.20kJ mol-1
Rotational3.72kJ mol-1
Vibrational306.39kJ mol-1
Total (Trans. + Rot. + Vib.)316.30kJ mol-1
Heat Capacity at Constant Pressure
PropertyValueUnit
Translational20.79J mol-1 K-1
Rotational12.47J mol-1 K-1
Vibrational49.22J mol-1 K-1
Total (Trans. + Rot. + Vib.)82.48J mol-1 K-1
Entropy
PropertyValueUnit
Translational159.82J mol-1 K-1
Rotational102.69J mol-1 K-1
Vibrational39.77J mol-1 K-1
Total (Trans. + Rot. + Vib.)302.28J mol-1 K-1
Other Properties
PropertyValueUnit
Heat of Formation1828.97kJ mol-1

Molecular Orbitals


Aqueous Solvation Energy at 298.15 K


Surface
Dipole
Translucent Molecule
PropertyValueUnit
Total Solvation Energy-892.87kJ mol-1
Polar Solvation Energy-903.06kJ mol-1
Nonpolar Solvation Energy10.24kJ mol-1
Surface Area80.63Å2
Charge of Molecule2
Dipole3.67Debye