Butane-1-thiol
Molecule Viewer
Molecular Orbitals
- 1 -2473.01 eV View
- 2 -301.49 eV View
- 3 -300.90 eV View
- 4 -300.63 eV View
- 5 -300.35 eV View
- 6 -238.42 eV View
- 7 -174.12 eV View
- 8 -174.04 eV View
- 9 -173.94 eV View
- 10 -28.88 eV View
- 11 -26.64 eV View
- 12 -24.27 eV View
- 13 -22.26 eV View
- 14 -20.19 eV View
- 15 -16.77 eV View
- 16 -16.29 eV View
- 17 -15.08 eV View
- 18 -14.26 eV View
- 19 -13.98 eV View
- 20 -13.12 eV View
- 21 -12.20 eV View
- 22 -11.96 eV View
- 23 -11.70 eV View
- 24 -10.35 eV View
- 25 -8.29 eV View
- 26 11.03 eV View
- 27 13.30 eV View
- 28 15.69 eV View
- 29 16.32 eV View
- 30 17.12 eV View
- 31 17.73 eV View
- 32 18.26 eV View
- 33 18.98 eV View
- 34 19.98 eV View
- 35 20.44 eV View
- 36 21.05 eV View
- 37 21.44 eV View
- 38 21.66 eV View
- 39 22.74 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 | 1.16 | kJ mol-1 |
| Polar Solvation Energy | -18.48 | kJ mol-1 |
| Nonpolar Solvation Energy | 19.65 | kJ mol-1 |
| Surface Area | 104.07 | Å2 |
| Charge of Molecule | 0 | |
| Dipole | 2.59 | Debye |