2-methylprop-1-ene
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 | 288.36 | kJ mol-1 |
| Total (Trans. + Rot. + Vib.) | 298.27 | 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 | 52.81 | J mol-1 K-1 |
| Total (Trans. + Rot. + Vib.) | 86.07 | J mol-1 K-1 |
| Entropy | ||
| Property | Value | Unit |
| Translational | 158.96 | J mol-1 K-1 |
| Rotational | 101.58 | J mol-1 K-1 |
| Vibrational | 41.86 | J mol-1 K-1 |
| Total (Trans. + Rot. + Vib.) | 302.41 | J mol-1 K-1 |
| Other Properties | ||
| Property | Value | Unit |
| Heat of Formation | -13.88 | kJ mol-1 |
Molecular Orbitals
- 1 -300.42 eV View
- 2 -300.42 eV View
- 3 -300.19 eV View
- 4 -299.24 eV View
- 5 -28.39 eV View
- 6 -24.48 eV View
- 7 -23.88 eV View
- 8 -18.41 eV View
- 9 -15.73 eV View
- 10 -15.57 eV View
- 11 -15.26 eV View
- 12 -13.76 eV View
- 13 -13.11 eV View
- 14 -12.63 eV View
- 15 -11.79 eV View
- 16 -7.96 eV View
- 17 8.72 eV View
- 18 16.72 eV View
- 19 17.21 eV View
- 20 19.04 eV View
- 21 19.10 eV View
- 22 19.61 eV View
- 23 20.06 eV View
- 24 20.20 eV View
- 25 20.62 eV View
- 26 20.66 eV View
- 27 25.91 eV View
- 28 28.85 eV View
Vibrational Frequencies
| Vibration |
|
| Vectors |
|
| Balls |
|
- 1 107.07 cm-1 View
- 2 128.16 cm-1 View
- 3 409.43 cm-1 View
- 4 458.63 cm-1 View
- 5 467.88 cm-1 View
- 6 618.12 cm-1 View
- 7 944.68 cm-1 View
- 8 946.17 cm-1 View
- 9 971.44 cm-1 View
- 10 972.02 cm-1 View
- 11 986.04 cm-1 View
- 12 1034.20 cm-1 View
- 13 1068.69 cm-1 View
- 14 1320.89 cm-1 View
- 15 1330.79 cm-1 View
- 16 1385.50 cm-1 View
- 17 1394.47 cm-1 View
- 18 1396.70 cm-1 View
- 19 1398.63 cm-1 View
- 20 1416.56 cm-1 View
- 21 1474.44 cm-1 View
- 22 1880.44 cm-1 View
- 23 3069.50 cm-1 View
- 24 3070.25 cm-1 View
- 25 3076.70 cm-1 View
- 26 3078.03 cm-1 View
- 27 3139.78 cm-1 View
- 28 3141.86 cm-1 View
- 29 3169.23 cm-1 View
- 30 3169.91 cm-1 View
Aqueous Solvation Energy at 298.15 K
| Surface |
|
| Dipole |
|
| Translucent Molecule |
|
| Property | Value | Unit |
| Total Solvation Energy | 11.12 | kJ mol-1 |
| Polar Solvation Energy | -1.99 | kJ mol-1 |
| Nonpolar Solvation Energy | 13.13 | kJ mol-1 |
| Surface Area | 77.38 | Å2 |
| Charge of Molecule | 0 | |
| Dipole | 0.46 | Debye |