Prop-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 | 207.18 | kJ mol-1 |
| Total (Trans. + Rot. + Vib.) | 217.09 | 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 | 22.69 | J mol-1 K-1 |
| Total (Trans. + Rot. + Vib.) | 55.95 | J mol-1 K-1 |
| Entropy | ||
| Property | Value | Unit |
| Translational | 155.37 | J mol-1 K-1 |
| Rotational | 92.08 | J mol-1 K-1 |
| Vibrational | 8.51 | J mol-1 K-1 |
| Total (Trans. + Rot. + Vib.) | 255.96 | J mol-1 K-1 |
| Other Properties | ||
| Property | Value | Unit |
| Heat of Formation | 29.59 | kJ mol-1 |
Molecular Orbitals
- 1 -300.46 eV View
- 2 -300.03 eV View
- 3 -299.50 eV View
- 4 -27.64 eV View
- 5 -24.05 eV View
- 6 -19.40 eV View
- 7 -16.24 eV View
- 8 -14.72 eV View
- 9 -14.58 eV View
- 10 -12.96 eV View
- 11 -12.04 eV View
- 12 -8.32 eV View
- 13 8.68 eV View
- 14 16.20 eV View
- 15 18.41 eV View
- 16 19.16 eV View
- 17 19.63 eV View
- 18 19.94 eV View
- 19 20.67 eV View
- 20 25.73 eV View
- 21 27.99 eV View
Aqueous Solvation Energy at 298.15 K
| Surface |
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| Dipole |
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| Translucent Molecule |
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| Property | Value | Unit |
| Total Solvation Energy | 10.19 | kJ mol-1 |
| Polar Solvation Energy | -1.58 | kJ mol-1 |
| Nonpolar Solvation Energy | 11.79 | kJ mol-1 |
| Surface Area | 71.45 | Å2 |
| Charge of Molecule | 0 | |
| Dipole | 0.24 | Debye |