3,3-dimethylbutan-2-one

Molecule Viewer


Thermodynamics at 298.15 K and standard pressure


Enthalpy
PropertyValueUnit
Translational6.20kJ mol-1
Rotational3.72kJ mol-1
Vibrational456.23kJ mol-1
Total (Trans. + Rot. + Vib.)466.15kJ mol-1
Heat Capacity at Constant Pressure
PropertyValueUnit
Translational20.79J mol-1 K-1
Rotational12.47J mol-1 K-1
Vibrational102.82J mol-1 K-1
Total (Trans. + Rot. + Vib.)136.08J mol-1 K-1
Entropy
PropertyValueUnit
Translational166.19J mol-1 K-1
Rotational115.12J mol-1 K-1
Vibrational76.89J mol-1 K-1
Total (Trans. + Rot. + Vib.)358.19J mol-1 K-1
Other Properties
PropertyValueUnit
Heat of Formation-279.54kJ mol-1

Molecular Orbitals


Aqueous Solvation Energy at 298.15 K


Surface
Dipole
Translucent Molecule
PropertyValueUnit
Total Solvation Energy3.14kJ mol-1
Polar Solvation Energy-14.43kJ mol-1
Nonpolar Solvation Energy17.60kJ mol-1
Surface Area104.12Å2
Charge of Molecule0
Dipole3.38Debye