1-oxidopyridin-1-ium
Molecule Viewer
Molecular Orbitals
- 1 -549.27 eV View
- 2 -423.83 eV View
- 3 -301.29 eV View
- 4 -301.28 eV View
- 5 -301.14 eV View
- 6 -301.14 eV View
- 7 -300.28 eV View
- 8 -38.13 eV View
- 9 -30.85 eV View
- 10 -27.35 eV View
- 11 -27.10 eV View
- 12 -22.59 eV View
- 13 -21.88 eV View
- 14 -18.16 eV View
- 15 -17.35 eV View
- 16 -16.79 eV View
- 17 -16.02 eV View
- 18 -15.26 eV View
- 19 -14.90 eV View
- 20 -13.10 eV View
- 21 -12.72 eV View
- 22 -11.29 eV View
- 23 -8.73 eV View
- 24 -8.41 eV View
- 25 -5.23 eV View
- 26 5.83 eV View
- 27 6.47 eV View
- 28 12.27 eV View
- 29 14.93 eV View
- 30 15.78 eV View
- 31 16.30 eV View
- 32 18.05 eV View
- 33 18.45 eV View
- 34 19.03 eV View
- 35 21.84 eV View
- 36 23.03 eV View
- 37 23.16 eV View
- 38 24.36 eV View
- 39 28.17 eV View
- 40 29.65 eV View
Aqueous Solvation Energy at 298.15 K
| Surface |
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| Dipole |
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| Translucent Molecule |
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| Property | Value | Unit |
| Total Solvation Energy | -12.41 | kJ mol-1 |
| Polar Solvation Energy | -27.17 | kJ mol-1 |
| Nonpolar Solvation Energy | 14.76 | kJ mol-1 |
| Surface Area | 94.75 | Å2 |
| Charge of Molecule | 0 | |
| Dipole | 5.13 | Debye |