4-nitrophenol

Molecule Viewer


Thermodynamics at 298.15 K and standard pressure


Enthalpy
PropertyValueUnit
Translational6.20kJ mol-1
Rotational3.72kJ mol-1
Vibrational298.75kJ mol-1
Total (Trans. + Rot. + Vib.)308.67kJ mol-1
Heat Capacity at Constant Pressure
PropertyValueUnit
Translational20.79J mol-1 K-1
Rotational12.47J mol-1 K-1
Vibrational101.10J mol-1 K-1
Total (Trans. + Rot. + Vib.)134.36J mol-1 K-1
Entropy
PropertyValueUnit
Translational170.29J mol-1 K-1
Rotational123.03J mol-1 K-1
Vibrational85.62J mol-1 K-1
Total (Trans. + Rot. + Vib.)378.93J mol-1 K-1
Other Properties
PropertyValueUnit
Heat of Formation-132.41kJ mol-1

Molecular Orbitals


Aqueous Solvation Energy at 298.15 K


Surface
Dipole
Translucent Molecule
PropertyValueUnit
Total Solvation Energy-30.91kJ mol-1
Polar Solvation Energy-41.09kJ mol-1
Nonpolar Solvation Energy10.16kJ mol-1
Surface Area127.07Å2
Charge of Molecule0
Dipole6.68Debye