Ethenyl acetate
Molecule Viewer
Thermodynamics at 298.15 K and standard pressure
| Enthalpy | ||
| Property | Value | Unit |
| Translational | 6.20 | kJ mol-1 |
| Rotational | 3.72 | kJ mol-1 |
| Vibrational | 254.45 | kJ mol-1 |
| Total (Trans. + Rot. + Vib.) | 264.37 | kJ mol-1 |
| Heat Capacity at Constant Pressure | ||
| Property | Value | Unit |
| Translational | 20.79 | J mol-1 K-1 |
| Rotational | 12.47 | J mol-1 K-1 |
| Vibrational | 71.43 | J mol-1 K-1 |
| Total (Trans. + Rot. + Vib.) | 104.69 | J mol-1 K-1 |
| Entropy | ||
| Property | Value | Unit |
| Translational | 164.30 | J mol-1 K-1 |
| Rotational | 111.10 | J mol-1 K-1 |
| Vibrational | 73.17 | J mol-1 K-1 |
| Total (Trans. + Rot. + Vib.) | 348.57 | J mol-1 K-1 |
| Other Properties | ||
| Property | Value | Unit |
| Heat of Formation | -286.21 | kJ mol-1 |
Molecular Orbitals
- 1 -552.79 eV View
- 2 -551.39 eV View
- 3 -304.28 eV View
- 4 -301.77 eV View
- 5 -301.26 eV View
- 6 -299.65 eV View
- 7 -37.88 eV View
- 8 -35.09 eV View
- 9 -27.14 eV View
- 10 -25.91 eV View
- 11 -20.93 eV View
- 12 -19.21 eV View
- 13 -17.32 eV View
- 14 -16.18 eV View
- 15 -16.02 eV View
- 16 -14.86 eV View
- 17 -14.35 eV View
- 18 -13.95 eV View
- 19 -13.63 eV View
- 20 -11.55 eV View
- 21 -10.83 eV View
- 22 -9.55 eV View
- 23 -7.53 eV View
- 24 7.64 eV View
- 25 9.27 eV View
- 26 14.17 eV View
- 27 17.05 eV View
- 28 17.46 eV View
- 29 18.36 eV View
- 30 18.86 eV View
- 31 19.11 eV View
- 32 19.42 eV View
- 33 20.85 eV View
- 34 24.91 eV View
- 35 26.50 eV View
- 36 28.03 eV View
Vibrational Frequencies
| Vibration |
|
| Vectors |
|
| Balls |
|
- 1 56.54 cm-1 View
- 2 84.00 cm-1 View
- 3 112.88 cm-1 View
- 4 214.81 cm-1 View
- 5 411.00 cm-1 View
- 6 437.67 cm-1 View
- 7 560.09 cm-1 View
- 8 625.23 cm-1 View
- 9 653.23 cm-1 View
- 10 889.38 cm-1 View
- 11 894.96 cm-1 View
- 12 988.27 cm-1 View
- 13 1000.48 cm-1 View
- 14 1009.60 cm-1 View
- 15 1023.97 cm-1 View
- 16 1176.95 cm-1 View
- 17 1268.75 cm-1 View
- 18 1320.53 cm-1 View
- 19 1336.13 cm-1 View
- 20 1377.12 cm-1 View
- 21 1387.17 cm-1 View
- 22 1399.71 cm-1 View
- 23 1823.59 cm-1 View
- 24 1983.20 cm-1 View
- 25 3009.72 cm-1 View
- 26 3083.02 cm-1 View
- 27 3089.03 cm-1 View
- 28 3149.80 cm-1 View
- 29 3153.79 cm-1 View
- 30 3175.22 cm-1 View
Aqueous Solvation Energy at 298.15 K
| Surface |
|
| Dipole |
|
| Translucent Molecule |
|
| Property | Value | Unit |
| Total Solvation Energy | -4.24 | kJ mol-1 |
| Polar Solvation Energy | -15.77 | kJ mol-1 |
| Nonpolar Solvation Energy | 11.54 | kJ mol-1 |
| Surface Area | 104.21 | Å2 |
| Charge of Molecule | 0 | |
| Dipole | 2.14 | Debye |