Molecule Viewer
Molecular Orbitals
- 1 -2157.89 eV View
- 2 -549.72 eV View
- 3 -549.72 eV View
- 4 -546.95 eV View
- 5 -300.12 eV View
- 6 -299.79 eV View
- 7 -206.01 eV View
- 8 -147.03 eV View
- 9 -146.96 eV View
- 10 -146.92 eV View
- 11 -35.49 eV View
- 12 -34.14 eV View
- 13 -32.26 eV View
- 14 -26.96 eV View
- 15 -23.74 eV View
- 16 -20.90 eV View
- 17 -18.00 eV View
- 18 -17.21 eV View
- 19 -15.93 eV View
- 20 -15.11 eV View
- 21 -14.09 eV View
- 22 -12.79 eV View
- 23 -12.56 eV View
- 24 -12.55 eV View
- 25 -12.01 eV View
- 26 -10.39 eV View
- 27 -10.36 eV View
- 28 -10.00 eV View
- 29 -8.28 eV View
- 30 -7.30 eV View
- 31 10.65 eV View
- 32 11.13 eV View
- 33 13.68 eV View
- 34 15.28 eV View
- 35 17.32 eV View
- 36 18.72 eV View
- 37 19.45 eV View
- 38 19.71 eV View
- 39 20.19 eV View
- 40 20.57 eV View
- 41 21.38 eV View
- 42 21.43 eV View
- 43 22.39 eV View
Aqueous Solvation Energy at 298.15 K
| Surface |
|
| Dipole |
|
| Translucent Molecule |
|
| Property | Value | Unit |
| Total Solvation Energy | -18.58 | kJ mol-1 |
| Polar Solvation Energy | -29.33 | kJ mol-1 |
| Nonpolar Solvation Energy | 10.74 | kJ mol-1 |
| Surface Area | 105.48 | Å2 |
| Charge of Molecule | 0 | |
| Dipole | 1.49 | Debye |