Molecule Viewer


Thermodynamics at 298.15 K and standard pressure


Enthalpy
PropertyValueUnit
Translational6.20kJ mol-1
Rotational2.48kJ mol-1
Vibrational31.92kJ mol-1
Total (Trans. + Rot. + Vib.)40.59kJ mol-1
Heat Capacity at Constant Pressure
PropertyValueUnit
Translational20.79J mol-1 K-1
Rotational8.31J mol-1 K-1
Vibrational10.10J mol-1 K-1
Total (Trans. + Rot. + Vib.)39.20J mol-1 K-1
Entropy
PropertyValueUnit
Translational156.49J mol-1 K-1
Rotational60.12J mol-1 K-1
Vibrational4.89J mol-1 K-1
Total (Trans. + Rot. + Vib.)221.50J mol-1 K-1
Other Properties
PropertyValueUnit
Heat of Formation871.10kJ mol-1

Molecular Orbitals


Vibrational Frequencies


Vibration
Vectors
Balls

Aqueous Solvation Energy at 298.15 K


Surface
Dipole
Translucent Molecule
PropertyValueUnit
Total Solvation Energy-339.65kJ mol-1
Polar Solvation Energy-343.83kJ mol-1
Nonpolar Solvation Energy4.18kJ mol-1
Surface Area58.35Å2
Charge of Molecule1
Dipole0.00Debye