Pentane
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 | 427.00 | kJ mol-1 |
| Total (Trans. + Rot. + Vib.) | 436.91 | 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 | 76.37 | J mol-1 K-1 |
| Total (Trans. + Rot. + Vib.) | 109.63 | J mol-1 K-1 |
| Entropy | ||
| Property | Value | Unit |
| Translational | 162.10 | J mol-1 K-1 |
| Rotational | 109.14 | J mol-1 K-1 |
| Vibrational | 60.93 | J mol-1 K-1 |
| Total (Trans. + Rot. + Vib.) | 332.17 | J mol-1 K-1 |
| Other Properties | ||
| Property | Value | Unit |
| Heat of Formation | -142.65 | kJ mol-1 |
Molecular Orbitals
- 1 -300.37 eV View
- 2 -300.34 eV View
- 3 -300.28 eV View
- 4 -300.18 eV View
- 5 -300.14 eV View
- 6 -28.46 eV View
- 7 -26.50 eV View
- 8 -23.93 eV View
- 9 -21.63 eV View
- 10 -20.04 eV View
- 11 -16.50 eV View
- 12 -15.82 eV View
- 13 -15.27 eV View
- 14 -14.61 eV View
- 15 -13.75 eV View
- 16 -13.16 eV View
- 17 -12.69 eV View
- 18 -12.17 eV View
- 19 -11.49 eV View
- 20 -11.29 eV View
- 21 -10.93 eV View
- 22 15.71 eV View
- 23 15.97 eV View
- 24 17.42 eV View
- 25 17.70 eV View
- 26 18.16 eV View
- 27 18.83 eV View
- 28 18.97 eV View
- 29 19.93 eV View
- 30 20.30 eV View
- 31 20.60 eV View
- 32 21.05 eV View
- 33 21.28 eV View
- 34 21.62 eV View
- 35 22.17 eV View
- 36 22.25 eV View
- 37 23.27 eV View
Aqueous Solvation Energy at 298.15 K
| Surface |
|
| Dipole |
|
| Translucent Molecule |
|
| Property | Value | Unit |
| Total Solvation Energy | 17.81 | kJ mol-1 |
| Polar Solvation Energy | -0.68 | kJ mol-1 |
| Nonpolar Solvation Energy | 18.52 | kJ mol-1 |
| Surface Area | 89.46 | Å2 |
| Charge of Molecule | 0 | |
| Dipole | 0.05 | Debye |