Adamantane
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 | 639.41 | kJ mol-1 |
| Total (Trans. + Rot. + Vib.) | 649.33 | 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 | 110.01 | J mol-1 K-1 |
| Total (Trans. + Rot. + Vib.) | 143.26 | J mol-1 K-1 |
| Entropy | ||
| Property | Value | Unit |
| Translational | 170.03 | J mol-1 K-1 |
| Rotational | 119.56 | J mol-1 K-1 |
| Vibrational | 49.21 | J mol-1 K-1 |
| Total (Trans. + Rot. + Vib.) | 338.79 | J mol-1 K-1 |
| Other Properties | ||
| Property | Value | Unit |
| Heat of Formation | -144.79 | kJ mol-1 |
Molecular Orbitals
- 1 -300.38 eV View
- 2 -300.38 eV View
- 3 -300.38 eV View
- 4 -300.38 eV View
- 5 -300.16 eV View
- 6 -300.16 eV View
- 7 -300.15 eV View
- 8 -300.15 eV View
- 9 -300.15 eV View
- 10 -300.15 eV View
- 11 -30.64 eV View
- 12 -27.10 eV View
- 13 -27.10 eV View
- 14 -27.10 eV View
- 15 -23.51 eV View
- 16 -23.51 eV View
- 17 -20.49 eV View
- 18 -20.49 eV View
- 19 -20.49 eV View
- 20 -18.25 eV View
- 21 -16.07 eV View
- 22 -15.73 eV View
- 23 -15.73 eV View
- 24 -15.73 eV View
- 25 -14.18 eV View
- 26 -14.18 eV View
- 27 -14.18 eV View
- 28 -13.64 eV View
- 29 -13.64 eV View
- 30 -13.64 eV View
- 31 -11.52 eV View
- 32 -11.52 eV View
- 33 -11.39 eV View
- 34 -11.38 eV View
- 35 -11.38 eV View
- 36 -9.72 eV View
- 37 -9.72 eV View
- 38 -9.72 eV View
- 39 15.16 eV View
- 40 15.16 eV View
- 41 15.16 eV View
- 42 15.76 eV View
- 43 17.61 eV View
- 44 17.62 eV View
- 45 18.14 eV View
- 46 18.14 eV View
- 47 18.14 eV View
- 48 18.15 eV View
- 49 18.15 eV View
- 50 18.15 eV View
- 51 19.43 eV View
- 52 19.43 eV View
- 53 19.43 eV View
- 54 20.61 eV View
- 55 20.96 eV View
- 56 20.97 eV View
- 57 21.47 eV View
- 58 21.47 eV View
- 59 21.48 eV View
- 60 22.29 eV View
- 61 22.29 eV View
- 62 22.29 eV View
- 63 22.91 eV View
- 64 22.92 eV View
- 65 22.92 eV View
- 66 22.93 eV View
Vibrational Frequencies
| Vibration |
|
| Vectors |
|
| Balls |
|
- 1 323.82 cm-1 View
- 2 324.05 cm-1 View
- 3 324.22 cm-1 View
- 4 428.14 cm-1 View
- 5 428.23 cm-1 View
- 6 456.00 cm-1 View
- 7 456.08 cm-1 View
- 8 456.48 cm-1 View
- 9 676.80 cm-1 View
- 10 676.82 cm-1 View
- 11 676.91 cm-1 View
- 12 893.84 cm-1 View
- 13 893.94 cm-1 View
- 14 894.05 cm-1 View
- 15 906.73 cm-1 View
- 16 906.79 cm-1 View
- 17 906.85 cm-1 View
- 18 921.12 cm-1 View
- 19 959.10 cm-1 View
- 20 959.24 cm-1 View
- 21 972.72 cm-1 View
- 22 972.73 cm-1 View
- 23 972.90 cm-1 View
- 24 984.83 cm-1 View
- 25 1044.54 cm-1 View
- 26 1044.64 cm-1 View
- 27 1044.72 cm-1 View
- 28 1057.01 cm-1 View
- 29 1101.07 cm-1 View
- 30 1101.16 cm-1 View
- 31 1101.18 cm-1 View
- 32 1124.37 cm-1 View
- 33 1124.49 cm-1 View
- 34 1144.91 cm-1 View
- 35 1144.95 cm-1 View
- 36 1145.06 cm-1 View
- 37 1249.19 cm-1 View
- 38 1249.22 cm-1 View
- 39 1249.23 cm-1 View
- 40 1310.84 cm-1 View
- 41 1310.89 cm-1 View
- 42 1310.90 cm-1 View
- 43 1328.83 cm-1 View
- 44 1328.85 cm-1 View
- 45 1328.95 cm-1 View
- 46 1331.29 cm-1 View
- 47 1331.39 cm-1 View
- 48 1362.29 cm-1 View
- 49 1362.36 cm-1 View
- 50 1362.37 cm-1 View
- 51 1408.26 cm-1 View
- 52 1408.35 cm-1 View
- 53 1413.42 cm-1 View
- 54 1413.47 cm-1 View
- 55 1413.54 cm-1 View
- 56 1425.34 cm-1 View
- 57 2909.41 cm-1 View
- 58 2909.62 cm-1 View
- 59 2909.67 cm-1 View
- 60 2911.97 cm-1 View
- 61 2967.22 cm-1 View
- 62 2967.40 cm-1 View
- 63 2967.49 cm-1 View
- 64 2969.11 cm-1 View
- 65 2969.25 cm-1 View
- 66 2969.35 cm-1 View
- 67 3039.80 cm-1 View
- 68 3040.74 cm-1 View
- 69 3041.02 cm-1 View
- 70 3041.04 cm-1 View
- 71 3041.59 cm-1 View
- 72 3041.60 cm-1 View
Aqueous Solvation Energy at 298.15 K
| Surface |
|
| Dipole |
|
| Translucent Molecule |
|
| Property | Value | Unit |
| Total Solvation Energy | 18.01 | kJ mol-1 |
| Polar Solvation Energy | -0.70 | kJ mol-1 |
| Nonpolar Solvation Energy | 18.73 | kJ mol-1 |
| Surface Area | 114.38 | Å2 |
| Charge of Molecule | 0 | |
| Dipole | 0.00 | Debye |