Molecule Viewer
Molecular Orbitals
- 1 -310.02 eV View
- 2 -308.36 eV View
- 3 -306.49 eV View
- 4 -306.40 eV View
- 5 -306.38 eV View
- 6 -305.21 eV View
- 7 -303.73 eV View
- 8 -303.55 eV View
- 9 -303.34 eV View
- 10 -302.93 eV View
- 11 -35.85 eV View
- 12 -32.86 eV View
- 13 -32.40 eV View
- 14 -31.21 eV View
- 15 -28.76 eV View
- 16 -27.89 eV View
- 17 -27.59 eV View
- 18 -25.87 eV View
- 19 -24.24 eV View
- 20 -22.83 eV View
- 21 -22.40 eV View
- 22 -21.37 eV View
- 23 -20.64 eV View
- 24 -20.47 eV View
- 25 -19.44 eV View
- 26 -19.35 eV View
- 27 -19.15 eV View
- 28 -18.97 eV View
- 29 -18.22 eV View
- 30 -17.81 eV View
- 31 -17.53 eV View
- 32 -17.19 eV View
- 33 -16.83 eV View
- 34 -16.26 eV View
- 35 -15.57 eV View
- 36 -15.46 eV View
- 37 -14.92 eV View
- 38 -11.07 eV View
- 39 -3.04 eV View
- 40 3.68 eV View
- 41 4.77 eV View
- 42 9.72 eV View
- 43 10.26 eV View
- 44 10.94 eV View
- 45 11.67 eV View
- 46 12.37 eV View
- 47 13.03 eV View
- 48 13.33 eV View
- 49 13.68 eV View
- 50 14.20 eV View
- 51 14.36 eV View
- 52 14.64 eV View
- 53 14.98 eV View
- 54 15.37 eV View
- 55 15.66 eV View
- 56 15.83 eV View
- 57 16.58 eV View
- 58 16.73 eV View
- 59 16.94 eV View
- 60 17.16 eV View
- 61 17.62 eV View
- 62 17.83 eV View
- 63 18.14 eV View
- 64 19.93 eV View
- 65 21.14 eV View
- 66 22.70 eV View
- 67 25.37 eV View
Aqueous Solvation Energy at 298.15 K
| Surface |
|
| Dipole |
|
| Translucent Molecule |
|
| Property | Value | Unit |
| Total Solvation Energy | -157.33 | kJ mol-1 |
| Polar Solvation Energy | -184.64 | kJ mol-1 |
| Nonpolar Solvation Energy | 27.30 | kJ mol-1 |
| Surface Area | 144.05 | Å2 |
| Charge of Molecule | 1 | |
| Dipole | 8.17 | Debye |