(3s)-3-hydroxypentanoic acid
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 | 414.90 | kJ mol-1 |
| Total (Trans. + Rot. + Vib.) | 424.81 | 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 | 109.51 | J mol-1 K-1 |
| Total (Trans. + Rot. + Vib.) | 142.77 | J mol-1 K-1 |
| Entropy | ||
| Property | Value | Unit |
| Translational | 168.25 | J mol-1 K-1 |
| Rotational | 120.27 | J mol-1 K-1 |
| Vibrational | 90.44 | J mol-1 K-1 |
| Total (Trans. + Rot. + Vib.) | 378.96 | J mol-1 K-1 |
| Other Properties | ||
| Property | Value | Unit |
| Heat of Formation | -657.58 | kJ mol-1 |
Molecular Orbitals
- 1 -552.11 eV View
- 2 -551.55 eV View
- 3 -550.43 eV View
- 4 -303.49 eV View
- 5 -302.76 eV View
- 6 -301.37 eV View
- 7 -301.27 eV View
- 8 -300.86 eV View
- 9 -37.22 eV View
- 10 -36.28 eV View
- 11 -34.07 eV View
- 12 -28.72 eV View
- 13 -26.63 eV View
- 14 -23.59 eV View
- 15 -21.48 eV View
- 16 -19.65 eV View
- 17 -18.39 eV View
- 18 -17.12 eV View
- 19 -16.41 eV View
- 20 -16.01 eV View
- 21 -15.40 eV View
- 22 -14.84 eV View
- 23 -14.24 eV View
- 24 -13.80 eV View
- 25 -13.18 eV View
- 26 -12.86 eV View
- 27 -12.71 eV View
- 28 -12.27 eV View
- 29 -11.29 eV View
- 30 -10.15 eV View
- 31 -8.74 eV View
- 32 -8.68 eV View
- 33 8.84 eV View
- 34 13.75 eV View
- 35 14.88 eV View
- 36 15.61 eV View
- 37 16.63 eV View
- 38 17.22 eV View
- 39 17.62 eV View
- 40 17.87 eV View
- 41 18.59 eV View
- 42 18.71 eV View
- 43 19.24 eV View
- 44 20.09 eV View
- 45 20.31 eV View
- 46 20.62 eV View
- 47 20.91 eV View
- 48 22.09 eV View
- 49 23.55 eV View
- 50 27.83 eV View
Aqueous Solvation Energy at 298.15 K
| Surface |
|
| Dipole |
|
| Translucent Molecule |
|
| Property | Value | Unit |
| Total Solvation Energy | -16.24 | kJ mol-1 |
| Polar Solvation Energy | -36.17 | kJ mol-1 |
| Nonpolar Solvation Energy | 19.94 | kJ mol-1 |
| Surface Area | 112.91 | Å2 |
| Charge of Molecule | 0 | |
| Dipole | 6.33 | Debye |