Methyl acetate

Molecule Viewer


Thermodynamics at 298.15 K and standard pressure


Enthalpy
PropertyValueUnit
Translational6.20kJ mol-1
Rotational3.72kJ mol-1
Vibrational239.93kJ mol-1
Total (Trans. + Rot. + Vib.)249.85kJ mol-1
Heat Capacity at Constant Pressure
PropertyValueUnit
Translational20.79J mol-1 K-1
Rotational12.47J mol-1 K-1
Vibrational58.62J mol-1 K-1
Total (Trans. + Rot. + Vib.)91.88J mol-1 K-1
Entropy
PropertyValueUnit
Translational162.43J mol-1 K-1
Rotational106.01J mol-1 K-1
Vibrational55.92J mol-1 K-1
Total (Trans. + Rot. + Vib.)324.36J mol-1 K-1
Other Properties
PropertyValueUnit
Heat of Formation-393.30kJ mol-1

Molecular Orbitals


Vibrational Frequencies


Vibration
Vectors
Balls
  • 1 77.34 cm-1 View
  • 2 129.13 cm-1 View
  • 3 171.63 cm-1 View
  • 4 283.10 cm-1 View
  • 5 429.40 cm-1 View
  • 6 566.65 cm-1 View
  • 7 587.26 cm-1 View
  • 8 900.91 cm-1 View
  • 9 989.04 cm-1 View
  • 10 1005.39 cm-1 View
  • 11 1015.86 cm-1 View
  • 12 1104.81 cm-1 View
  • 13 1147.92 cm-1 View
  • 14 1336.26 cm-1 View
  • 15 1348.96 cm-1 View
  • 16 1364.42 cm-1 View
  • 17 1367.69 cm-1 View
  • 18 1382.16 cm-1 View
  • 19 1387.85 cm-1 View
  • 20 1407.00 cm-1 View
  • 21 1977.11 cm-1 View
  • 22 3057.49 cm-1 View
  • 23 3084.03 cm-1 View
  • 24 3088.65 cm-1 View
  • 25 3090.49 cm-1 View
  • 26 3142.16 cm-1 View
  • 27 3176.70 cm-1 View

Aqueous Solvation Energy at 298.15 K


Surface
Dipole
Translucent Molecule
PropertyValueUnit
Total Solvation Energy-3.90kJ mol-1
Polar Solvation Energy-17.29kJ mol-1
Nonpolar Solvation Energy13.42kJ mol-1
Surface Area84.57Å2
Charge of Molecule0
Dipole2.30Debye