Molecule Viewer
Molecular Orbitals
- 1 -2157.88 eV View
- 2 -549.60 eV View
- 3 -549.38 eV View
- 4 -546.82 eV View
- 5 -299.49 eV View
- 6 -206.01 eV View
- 7 -147.03 eV View
- 8 -146.96 eV View
- 9 -146.92 eV View
- 10 -35.53 eV View
- 11 -34.03 eV View
- 12 -31.87 eV View
- 13 -25.77 eV View
- 14 -22.07 eV View
- 15 -17.35 eV View
- 16 -17.10 eV View
- 17 -16.43 eV View
- 18 -13.97 eV View
- 19 -13.88 eV View
- 20 -13.13 eV View
- 21 -12.40 eV View
- 22 -10.10 eV View
- 23 -9.95 eV View
- 24 -9.35 eV View
- 25 -8.57 eV View
- 26 -7.28 eV View
- 27 10.59 eV View
- 28 11.67 eV View
- 29 14.31 eV View
- 30 15.17 eV View
- 31 19.26 eV View
- 32 19.50 eV View
- 33 19.81 eV View
- 34 20.38 eV View
- 35 20.60 eV View
- 36 21.98 eV View
Aqueous Solvation Energy at 298.15 K
| Surface |
|
| Dipole |
|
| Translucent Molecule |
|
| Property | Value | Unit |
| Total Solvation Energy | -25.37 | kJ mol-1 |
| Polar Solvation Energy | -28.78 | kJ mol-1 |
| Nonpolar Solvation Energy | 3.43 | kJ mol-1 |
| Surface Area | 94.10 | Å2 |
| Charge of Molecule | 0 | |
| Dipole | 2.11 | Debye |