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.)249.84kJ mol-1
Heat Capacity at Constant Pressure
PropertyValueUnit
Translational20.79J mol-1 K-1
Rotational12.47J mol-1 K-1
Vibrational58.61J mol-1 K-1
Total (Trans. + Rot. + Vib.)91.87J mol-1 K-1
Entropy
PropertyValueUnit
Translational162.43J mol-1 K-1
Rotational106.01J mol-1 K-1
Vibrational55.82J mol-1 K-1
Total (Trans. + Rot. + Vib.)324.27J mol-1 K-1
Other Properties
PropertyValueUnit
Heat of Formation-393.33kJ mol-1

Molecular Orbitals


Vibrational Frequencies


Vibration
Vectors
Balls
  • 1 77.52 cm-1 View
  • 2 129.20 cm-1 View
  • 3 173.08 cm-1 View
  • 4 283.23 cm-1 View
  • 5 429.44 cm-1 View
  • 6 566.86 cm-1 View
  • 7 587.28 cm-1 View
  • 8 901.01 cm-1 View
  • 9 988.94 cm-1 View
  • 10 1005.20 cm-1 View
  • 11 1015.72 cm-1 View
  • 12 1104.93 cm-1 View
  • 13 1148.08 cm-1 View
  • 14 1336.27 cm-1 View
  • 15 1349.05 cm-1 View
  • 16 1364.27 cm-1 View
  • 17 1367.83 cm-1 View
  • 18 1382.03 cm-1 View
  • 19 1388.00 cm-1 View
  • 20 1406.99 cm-1 View
  • 21 1977.26 cm-1 View
  • 22 3057.33 cm-1 View
  • 23 3083.70 cm-1 View
  • 24 3088.26 cm-1 View
  • 25 3090.81 cm-1 View
  • 26 3141.15 cm-1 View
  • 27 3176.70 cm-1 View

Aqueous Solvation Energy at 298.15 K


Surface
Dipole
Translucent Molecule
PropertyValueUnit
Total Solvation Energy-7.80kJ mol-1
Polar Solvation Energy-17.32kJ mol-1
Nonpolar Solvation Energy9.53kJ mol-1
Surface Area89.77Å2
Charge of Molecule0
Dipole2.29Debye