2-hydroxybenzoic 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 | 330.46 | kJ mol-1 |
| Total (Trans. + Rot. + Vib.) | 340.38 | 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 | 100.31 | J mol-1 K-1 |
| Total (Trans. + Rot. + Vib.) | 133.56 | J mol-1 K-1 |
| Entropy | ||
| Property | Value | Unit |
| Translational | 170.20 | J mol-1 K-1 |
| Rotational | 122.80 | J mol-1 K-1 |
| Vibrational | 66.96 | J mol-1 K-1 |
| Total (Trans. + Rot. + Vib.) | 359.95 | J mol-1 K-1 |
| Other Properties | ||
| Property | Value | Unit |
| Heat of Formation | -457.24 | kJ mol-1 |
Molecular Orbitals
- 1 -553.39 eV View
- 2 -551.37 eV View
- 3 -550.28 eV View
- 4 -303.49 eV View
- 5 -302.77 eV View
- 6 -301.03 eV View
- 7 -300.94 eV View
- 8 -300.82 eV View
- 9 -300.69 eV View
- 10 -300.51 eV View
- 11 -37.46 eV View
- 12 -36.89 eV View
- 13 -33.93 eV View
- 14 -30.30 eV View
- 15 -27.07 eV View
- 16 -26.34 eV View
- 17 -22.41 eV View
- 18 -21.74 eV View
- 19 -19.86 eV View
- 20 -18.97 eV View
- 21 -17.89 eV View
- 22 -16.86 eV View
- 23 -16.21 eV View
- 24 -15.42 eV View
- 25 -15.15 eV View
- 26 -14.16 eV View
- 27 -13.88 eV View
- 28 -13.68 eV View
- 29 -13.19 eV View
- 30 -12.55 eV View
- 31 -12.02 eV View
- 32 -11.06 eV View
- 33 -9.10 eV View
- 34 -8.75 eV View
- 35 -8.03 eV View
- 36 -7.34 eV View
- 37 5.67 eV View
- 38 6.80 eV View
- 39 9.98 eV View
- 40 13.64 eV View
- 41 14.06 eV View
- 42 15.25 eV View
- 43 16.16 eV View
- 44 17.03 eV View
- 45 17.96 eV View
- 46 18.74 eV View
- 47 19.16 eV View
- 48 19.33 eV View
- 49 21.17 eV View
- 50 22.68 eV View
- 51 23.58 eV View
- 52 23.79 eV View
- 53 25.10 eV View
- 54 27.69 eV View
- 55 29.76 eV View
- 56 30.57 eV View
Vibrational Frequencies
| Vibration |
|
| Vectors |
|
| Balls |
|
- 1 21.39 cm-1 View
- 2 112.88 cm-1 View
- 3 218.78 cm-1 View
- 4 242.61 cm-1 View
- 5 288.84 cm-1 View
- 6 386.99 cm-1 View
- 7 396.25 cm-1 View
- 8 441.52 cm-1 View
- 9 475.00 cm-1 View
- 10 485.58 cm-1 View
- 11 546.26 cm-1 View
- 12 562.27 cm-1 View
- 13 628.91 cm-1 View
- 14 660.77 cm-1 View
- 15 770.09 cm-1 View
- 16 788.06 cm-1 View
- 17 815.73 cm-1 View
- 18 882.76 cm-1 View
- 19 896.47 cm-1 View
- 20 968.73 cm-1 View
- 21 1016.30 cm-1 View
- 22 1108.42 cm-1 View
- 23 1116.75 cm-1 View
- 24 1155.11 cm-1 View
- 25 1202.06 cm-1 View
- 26 1232.89 cm-1 View
- 27 1283.32 cm-1 View
- 28 1363.26 cm-1 View
- 29 1400.18 cm-1 View
- 30 1452.60 cm-1 View
- 31 1516.94 cm-1 View
- 32 1588.57 cm-1 View
- 33 1617.99 cm-1 View
- 34 1782.31 cm-1 View
- 35 1802.98 cm-1 View
- 36 1974.09 cm-1 View
- 37 3026.12 cm-1 View
- 38 3051.57 cm-1 View
- 39 3058.13 cm-1 View
- 40 3074.14 cm-1 View
- 41 3875.15 cm-1 View
- 42 3881.08 cm-1 View
Aqueous Solvation Energy at 298.15 K
| Surface |
|
| Dipole |
|
| Translucent Molecule |
|
| Property | Value | Unit |
| Total Solvation Energy | -21.17 | kJ mol-1 |
| Polar Solvation Energy | -35.89 | kJ mol-1 |
| Nonpolar Solvation Energy | 14.71 | kJ mol-1 |
| Surface Area | 113.25 | Å2 |
| Charge of Molecule | 0 | |
| Dipole | 7.66 | Debye |