Molecule Viewer
Molecular Orbitals
- 1 -551.07 eV View
- 2 -551.07 eV View
- 3 -416.77 eV View
- 4 -302.88 eV View
- 5 -302.87 eV View
- 6 -301.32 eV View
- 7 -300.32 eV View
- 8 -300.30 eV View
- 9 -35.72 eV View
- 10 -35.37 eV View
- 11 -31.31 eV View
- 12 -27.75 eV View
- 13 -24.31 eV View
- 14 -23.70 eV View
- 15 -20.80 eV View
- 16 -19.65 eV View
- 17 -17.87 eV View
- 18 -16.43 eV View
- 19 -16.22 eV View
- 20 -15.20 eV View
- 21 -14.80 eV View
- 22 -14.65 eV View
- 23 -14.56 eV View
- 24 -13.45 eV View
- 25 -13.26 eV View
- 26 -11.83 eV View
- 27 -10.59 eV View
- 28 -9.84 eV View
- 29 -9.18 eV View
- 30 -8.92 eV View
- 31 -8.19 eV View
- 32 7.74 eV View
- 33 14.21 eV View
- 34 15.07 eV View
- 35 15.86 eV View
- 36 16.46 eV View
- 37 17.59 eV View
- 38 17.70 eV View
- 39 18.06 eV View
- 40 18.28 eV View
- 41 18.34 eV View
- 42 19.25 eV View
- 43 19.54 eV View
- 44 20.04 eV View
- 45 20.61 eV View
- 46 21.56 eV View
- 47 22.41 eV View
- 48 23.65 eV View
- 49 28.61 eV View
Aqueous Solvation Energy at 298.15 K
| Surface |
|
| Dipole |
|
| Translucent Molecule |
|
| Property | Value | Unit |
| Total Solvation Energy | -0.81 | kJ mol-1 |
| Polar Solvation Energy | -19.24 | kJ mol-1 |
| Nonpolar Solvation Energy | 18.43 | kJ mol-1 |
| Surface Area | 111.35 | Å2 |
| Charge of Molecule | 0 | |
| Dipole | 1.54 | Debye |