3-amino-2,2-dimethylpropan-1-ol
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 | 491.21 | kJ mol-1 |
| Total (Trans. + Rot. + Vib.) | 501.12 | 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 | 114.04 | J mol-1 K-1 |
| Total (Trans. + Rot. + Vib.) | 147.30 | J mol-1 K-1 |
| Entropy | ||
| Property | Value | Unit |
| Translational | 166.56 | J mol-1 K-1 |
| Rotational | 116.13 | J mol-1 K-1 |
| Vibrational | 88.07 | J mol-1 K-1 |
| Total (Trans. + Rot. + Vib.) | 370.76 | J mol-1 K-1 |
| Other Properties | ||
| Property | Value | Unit |
| Heat of Formation | -279.26 | kJ mol-1 |
Molecular Orbitals
- 1 -551.02 eV View
- 2 -416.29 eV View
- 3 -301.75 eV View
- 4 -301.22 eV View
- 5 -301.12 eV View
- 6 -300.58 eV View
- 7 -300.25 eV View
- 8 -35.33 eV View
- 9 -30.73 eV View
- 10 -28.44 eV View
- 11 -24.61 eV View
- 12 -23.66 eV View
- 13 -23.28 eV View
- 14 -19.30 eV View
- 15 -17.51 eV View
- 16 -16.73 eV View
- 17 -16.06 eV View
- 18 -15.25 eV View
- 19 -15.09 eV View
- 20 -14.70 eV View
- 21 -13.68 eV View
- 22 -13.61 eV View
- 23 -13.45 eV View
- 24 -12.99 eV View
- 25 -11.67 eV View
- 26 -11.51 eV View
- 27 -10.66 eV View
- 28 -9.40 eV View
- 29 -8.58 eV View
- 30 15.26 eV View
- 31 15.45 eV View
- 32 15.73 eV View
- 33 15.88 eV View
- 34 16.33 eV View
- 35 18.03 eV View
- 36 18.40 eV View
- 37 18.74 eV View
- 38 19.52 eV View
- 39 19.56 eV View
- 40 19.77 eV View
- 41 20.12 eV View
- 42 20.70 eV View
- 43 20.77 eV View
- 44 21.28 eV View
- 45 21.69 eV View
- 46 21.90 eV View
- 47 22.46 eV View
- 48 23.24 eV View
Vibrational Frequencies
| Vibration |
|
| Vectors |
|
| Balls |
|
- 1 106.95 cm-1 View
- 2 167.16 cm-1 View
- 3 197.13 cm-1 View
- 4 222.29 cm-1 View
- 5 226.32 cm-1 View
- 6 272.38 cm-1 View
- 7 322.03 cm-1 View
- 8 373.70 cm-1 View
- 9 382.66 cm-1 View
- 10 435.90 cm-1 View
- 11 450.09 cm-1 View
- 12 535.36 cm-1 View
- 13 553.58 cm-1 View
- 14 834.65 cm-1 View
- 15 875.84 cm-1 View
- 16 915.10 cm-1 View
- 17 939.09 cm-1 View
- 18 976.70 cm-1 View
- 19 994.08 cm-1 View
- 20 1014.59 cm-1 View
- 21 1049.91 cm-1 View
- 22 1070.45 cm-1 View
- 23 1084.90 cm-1 View
- 24 1132.82 cm-1 View
- 25 1160.05 cm-1 View
- 26 1181.85 cm-1 View
- 27 1250.60 cm-1 View
- 28 1273.07 cm-1 View
- 29 1300.65 cm-1 View
- 30 1347.96 cm-1 View
- 31 1354.72 cm-1 View
- 32 1377.38 cm-1 View
- 33 1384.34 cm-1 View
- 34 1401.42 cm-1 View
- 35 1405.68 cm-1 View
- 36 1407.03 cm-1 View
- 37 1411.25 cm-1 View
- 38 1417.24 cm-1 View
- 39 1421.72 cm-1 View
- 40 1460.75 cm-1 View
- 41 1672.51 cm-1 View
- 42 2905.90 cm-1 View
- 43 2934.25 cm-1 View
- 44 2983.23 cm-1 View
- 45 2983.83 cm-1 View
- 46 3047.28 cm-1 View
- 47 3076.39 cm-1 View
- 48 3082.15 cm-1 View
- 49 3083.51 cm-1 View
- 50 3166.89 cm-1 View
- 51 3175.53 cm-1 View
- 52 3355.64 cm-1 View
- 53 3505.18 cm-1 View
- 54 3831.54 cm-1 View
Aqueous Solvation Energy at 298.15 K
| Surface |
|
| Dipole |
|
| Translucent Molecule |
|
| Property | Value | Unit |
| Total Solvation Energy | 0.66 | kJ mol-1 |
| Polar Solvation Energy | -15.60 | kJ mol-1 |
| Nonpolar Solvation Energy | 16.26 | kJ mol-1 |
| Surface Area | 104.57 | Å2 |
| Charge of Molecule | 0 | |
| Dipole | 1.69 | Debye |