Molecule Viewer
Molecular Orbitals
- 1 -2157.98 eV View
- 2 -549.72 eV View
- 3 -549.72 eV View
- 4 -546.95 eV View
- 5 -299.54 eV View
- 6 -206.09 eV View
- 7 -147.11 eV View
- 8 -147.04 eV View
- 9 -147.00 eV View
- 10 -35.48 eV View
- 11 -34.12 eV View
- 12 -32.26 eV View
- 13 -25.79 eV View
- 14 -22.10 eV View
- 15 -17.99 eV View
- 16 -17.12 eV View
- 17 -15.98 eV View
- 18 -13.81 eV View
- 19 -13.79 eV View
- 20 -12.58 eV View
- 21 -12.42 eV View
- 22 -10.57 eV View
- 23 -10.36 eV View
- 24 -10.29 eV View
- 25 -8.28 eV View
- 26 -7.42 eV View
- 27 10.47 eV View
- 28 11.40 eV View
- 29 14.26 eV View
- 30 15.37 eV View
- 31 19.32 eV View
- 32 19.40 eV View
- 33 19.72 eV View
- 34 19.77 eV View
- 35 20.61 eV View
- 36 22.43 eV View
Aqueous Solvation Energy at 298.15 K
| Surface |
|
| Dipole |
|
| Translucent Molecule |
|
| Property | Value | Unit |
| Total Solvation Energy | -25.16 | kJ mol-1 |
| Polar Solvation Energy | -31.64 | kJ mol-1 |
| Nonpolar Solvation Energy | 6.48 | kJ mol-1 |
| Surface Area | 91.32 | Å2 |
| Charge of Molecule | 0 | |
| Dipole | 1.41 | Debye |