Methyl 2-methylprop-2-enoate
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 | 332.83 | kJ mol-1 |
| Total (Trans. + Rot. + Vib.) | 342.74 | 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 | 94.08 | J mol-1 K-1 |
| Total (Trans. + Rot. + Vib.) | 127.34 | J mol-1 K-1 |
| Entropy | ||
| Property | Value | Unit |
| Translational | 166.19 | J mol-1 K-1 |
| Rotational | 115.35 | J mol-1 K-1 |
| Vibrational | 97.67 | J mol-1 K-1 |
| Total (Trans. + Rot. + Vib.) | 379.20 | J mol-1 K-1 |
| Other Properties | ||
| Property | Value | Unit |
| Heat of Formation | -315.73 | kJ mol-1 |
Molecular Orbitals
- 1 -552.14 eV View
- 2 -551.05 eV View
- 3 -303.91 eV View
- 4 -302.17 eV View
- 5 -300.85 eV View
- 6 -300.82 eV View
- 7 -300.21 eV View
- 8 -37.55 eV View
- 9 -34.68 eV View
- 10 -28.53 eV View
- 11 -24.97 eV View
- 12 -24.51 eV View
- 13 -21.38 eV View
- 14 -18.37 eV View
- 15 -17.17 eV View
- 16 -16.61 eV View
- 17 -15.61 eV View
- 18 -15.38 eV View
- 19 -15.00 eV View
- 20 -14.72 eV View
- 21 -13.69 eV View
- 22 -13.26 eV View
- 23 -12.51 eV View
- 24 -11.20 eV View
- 25 -9.14 eV View
- 26 -9.06 eV View
- 27 -8.66 eV View
- 28 7.70 eV View
- 29 8.65 eV View
- 30 14.80 eV View
- 31 16.64 eV View
- 32 17.75 eV View
- 33 18.53 eV View
- 34 18.62 eV View
- 35 18.93 eV View
- 36 19.03 eV View
- 37 19.14 eV View
- 38 19.78 eV View
- 39 20.22 eV View
- 40 21.56 eV View
- 41 24.71 eV View
- 42 27.72 eV View
- 43 27.91 eV View
Vibrational Frequencies
| Vibration |
|
| Vectors |
|
| Balls |
|
- 1 28.40 cm-1 View
- 2 112.27 cm-1 View
- 3 121.46 cm-1 View
- 4 169.50 cm-1 View
- 5 197.63 cm-1 View
- 6 266.73 cm-1 View
- 7 343.72 cm-1 View
- 8 372.20 cm-1 View
- 9 569.39 cm-1 View
- 10 584.11 cm-1 View
- 11 637.51 cm-1 View
- 12 718.66 cm-1 View
- 13 853.57 cm-1 View
- 14 945.52 cm-1 View
- 15 983.05 cm-1 View
- 16 1001.27 cm-1 View
- 17 1011.54 cm-1 View
- 18 1046.55 cm-1 View
- 19 1086.84 cm-1 View
- 20 1124.30 cm-1 View
- 21 1266.52 cm-1 View
- 22 1319.71 cm-1 View
- 23 1348.77 cm-1 View
- 24 1362.83 cm-1 View
- 25 1365.85 cm-1 View
- 26 1374.63 cm-1 View
- 27 1391.13 cm-1 View
- 28 1396.95 cm-1 View
- 29 1449.00 cm-1 View
- 30 1871.04 cm-1 View
- 31 1984.31 cm-1 View
- 32 3057.02 cm-1 View
- 33 3071.80 cm-1 View
- 34 3076.92 cm-1 View
- 35 3088.19 cm-1 View
- 36 3134.38 cm-1 View
- 37 3141.11 cm-1 View
- 38 3142.24 cm-1 View
- 39 3167.90 cm-1 View
Aqueous Solvation Energy at 298.15 K
| Surface |
|
| Dipole |
|
| Translucent Molecule |
|
| Property | Value | Unit |
| Total Solvation Energy | 3.01 | kJ mol-1 |
| Polar Solvation Energy | -16.82 | kJ mol-1 |
| Nonpolar Solvation Energy | 19.86 | kJ mol-1 |
| Surface Area | 112.40 | Å2 |
| Charge of Molecule | 0 | |
| Dipole | 2.26 | Debye |