Methyl acetate

Molecule Viewer


Thermodynamics at 298.15 K and standard pressure


Enthalpy
PropertyValueUnit
Translational6.20kJ mol-1
Rotational3.72kJ mol-1
Vibrational240.16kJ mol-1
Total (Trans. + Rot. + Vib.)250.07kJ mol-1
Heat Capacity at Constant Pressure
PropertyValueUnit
Translational20.79J mol-1 K-1
Rotational12.47J mol-1 K-1
Vibrational58.17J mol-1 K-1
Total (Trans. + Rot. + Vib.)91.43J mol-1 K-1
Entropy
PropertyValueUnit
Translational162.43J mol-1 K-1
Rotational106.31J mol-1 K-1
Vibrational51.92J mol-1 K-1
Total (Trans. + Rot. + Vib.)320.66J mol-1 K-1
Other Properties
PropertyValueUnit
Heat of Formation-388.47kJ mol-1

Molecular Orbitals


Vibrational Frequencies


Vibration
Vectors
Balls
  • 1 98.15 cm-1 View
  • 2 131.42 cm-1 View
  • 3 202.28 cm-1 View
  • 4 298.13 cm-1 View
  • 5 471.74 cm-1 View
  • 6 553.88 cm-1 View
  • 7 567.71 cm-1 View
  • 8 901.91 cm-1 View
  • 9 989.44 cm-1 View
  • 10 1000.13 cm-1 View
  • 11 1013.76 cm-1 View
  • 12 1070.34 cm-1 View
  • 13 1163.94 cm-1 View
  • 14 1350.53 cm-1 View
  • 15 1358.52 cm-1 View
  • 16 1358.92 cm-1 View
  • 17 1379.81 cm-1 View
  • 18 1388.17 cm-1 View
  • 19 1394.21 cm-1 View
  • 20 1422.37 cm-1 View
  • 21 1992.82 cm-1 View
  • 22 3045.87 cm-1 View
  • 23 3077.39 cm-1 View
  • 24 3078.25 cm-1 View
  • 25 3086.96 cm-1 View
  • 26 3143.78 cm-1 View
  • 27 3173.38 cm-1 View

Aqueous Solvation Energy at 298.15 K


Surface
Dipole
Translucent Molecule
PropertyValueUnit
Total Solvation Energy-17.88kJ mol-1
Polar Solvation Energy-28.14kJ mol-1
Nonpolar Solvation Energy10.24kJ mol-1
Surface Area88.85Å2
Charge of Molecule0
Dipole5.18Debye