Molecule Viewer
Molecular Orbitals
- 1 -2167.62 eV View
- 2 -560.89 eV View
- 3 -559.97 eV View
- 4 -559.96 eV View
- 5 -216.05 eV View
- 6 -157.12 eV View
- 7 -156.96 eV View
- 8 -156.93 eV View
- 9 -46.01 eV View
- 10 -44.16 eV View
- 11 -43.41 eV View
- 12 -29.11 eV View
- 13 -27.24 eV View
- 14 -23.70 eV View
- 15 -22.46 eV View
- 16 -21.60 eV View
- 17 -20.30 eV View
- 18 -19.28 eV View
- 19 -18.45 eV View
- 20 -18.08 eV View
- 21 -3.08 eV View
- 22 -1.12 eV View
- 23 3.09 eV View
- 24 9.38 eV View
- 25 10.71 eV View
- 26 13.19 eV View
Aqueous Solvation Energy at 298.15 K
| Surface |
|
| Dipole |
|
| Translucent Molecule |
|
| Property | Value | Unit |
| Total Solvation Energy | -315.46 | kJ mol-1 |
| Polar Solvation Energy | -314.83 | kJ mol-1 |
| Nonpolar Solvation Energy | -0.63 | kJ mol-1 |
| Surface Area | 78.93 | Å2 |
| Charge of Molecule | 1 | |
| Dipole | 5.57 | Debye |