2,2,3-trimethylbutane
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 | 583.44 | kJ mol-1 |
| Total (Trans. + Rot. + Vib.) | 593.36 | 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 | 121.97 | J mol-1 K-1 |
| Total (Trans. + Rot. + Vib.) | 155.23 | J mol-1 K-1 |
| Entropy | ||
| Property | Value | Unit |
| Translational | 166.20 | J mol-1 K-1 |
| Rotational | 115.64 | J mol-1 K-1 |
| Vibrational | 87.40 | J mol-1 K-1 |
| Total (Trans. + Rot. + Vib.) | 369.23 | J mol-1 K-1 |
| Other Properties | ||
| Property | Value | Unit |
| Heat of Formation | -183.03 | kJ mol-1 |
Molecular Orbitals
- 1 -300.67 eV View
- 2 -300.47 eV View
- 3 -300.04 eV View
- 4 -300.04 eV View
- 5 -300.01 eV View
- 6 -300.00 eV View
- 7 -299.99 eV View
- 8 -29.41 eV View
- 9 -26.67 eV View
- 10 -24.63 eV View
- 11 -24.20 eV View
- 12 -23.63 eV View
- 13 -21.32 eV View
- 14 -18.36 eV View
- 15 -16.60 eV View
- 16 -15.88 eV View
- 17 -15.51 eV View
- 18 -15.29 eV View
- 19 -14.53 eV View
- 20 -13.73 eV View
- 21 -13.58 eV View
- 22 -13.17 eV View
- 23 -13.07 eV View
- 24 -12.82 eV View
- 25 -12.20 eV View
- 26 -12.11 eV View
- 27 -10.90 eV View
- 28 -10.63 eV View
- 29 -10.51 eV View
- 30 15.39 eV View
- 31 15.92 eV View
- 32 16.11 eV View
- 33 16.45 eV View
- 34 17.51 eV View
- 35 17.83 eV View
- 36 18.38 eV View
- 37 19.03 eV View
- 38 19.36 eV View
- 39 19.69 eV View
- 40 19.94 eV View
- 41 20.14 eV View
- 42 20.47 eV View
- 43 20.62 eV View
- 44 21.11 eV View
- 45 21.43 eV View
- 46 21.61 eV View
- 47 21.72 eV View
- 48 22.14 eV View
- 49 22.89 eV View
- 50 23.31 eV View
- 51 23.73 eV View
Vibrational Frequencies
| Vibration |
|
| Vectors |
|
| Balls |
|
- 1 128.36 cm-1 View
- 2 185.96 cm-1 View
- 3 221.18 cm-1 View
- 4 228.09 cm-1 View
- 5 253.29 cm-1 View
- 6 274.11 cm-1 View
- 7 326.59 cm-1 View
- 8 358.64 cm-1 View
- 9 408.37 cm-1 View
- 10 423.49 cm-1 View
- 11 455.92 cm-1 View
- 12 478.37 cm-1 View
- 13 501.75 cm-1 View
- 14 573.37 cm-1 View
- 15 802.02 cm-1 View
- 16 939.58 cm-1 View
- 17 964.73 cm-1 View
- 18 971.38 cm-1 View
- 19 976.37 cm-1 View
- 20 983.04 cm-1 View
- 21 989.98 cm-1 View
- 22 1002.09 cm-1 View
- 23 1023.69 cm-1 View
- 24 1034.28 cm-1 View
- 25 1076.87 cm-1 View
- 26 1126.69 cm-1 View
- 27 1159.48 cm-1 View
- 28 1220.35 cm-1 View
- 29 1281.16 cm-1 View
- 30 1311.16 cm-1 View
- 31 1320.79 cm-1 View
- 32 1333.78 cm-1 View
- 33 1391.85 cm-1 View
- 34 1396.64 cm-1 View
- 35 1400.88 cm-1 View
- 36 1401.66 cm-1 View
- 37 1403.41 cm-1 View
- 38 1405.38 cm-1 View
- 39 1407.10 cm-1 View
- 40 1408.47 cm-1 View
- 41 1412.61 cm-1 View
- 42 1413.72 cm-1 View
- 43 1418.15 cm-1 View
- 44 1420.84 cm-1 View
- 45 1424.96 cm-1 View
- 46 1432.11 cm-1 View
- 47 1474.72 cm-1 View
- 48 2867.84 cm-1 View
- 49 3023.99 cm-1 View
- 50 3043.45 cm-1 View
- 51 3046.39 cm-1 View
- 52 3051.88 cm-1 View
- 53 3057.30 cm-1 View
- 54 3076.77 cm-1 View
- 55 3079.00 cm-1 View
- 56 3080.79 cm-1 View
- 57 3081.75 cm-1 View
- 58 3083.73 cm-1 View
- 59 3151.46 cm-1 View
- 60 3161.66 cm-1 View
- 61 3164.67 cm-1 View
- 62 3165.89 cm-1 View
- 63 3167.41 cm-1 View
Aqueous Solvation Energy at 298.15 K
| Surface |
|
| Dipole |
|
| Translucent Molecule |
|
| Property | Value | Unit |
| Total Solvation Energy | 19.11 | kJ mol-1 |
| Polar Solvation Energy | -0.60 | kJ mol-1 |
| Nonpolar Solvation Energy | 19.73 | kJ mol-1 |
| Surface Area | 100.27 | Å2 |
| Charge of Molecule | 0 | |
| Dipole | 0.05 | Debye |