Molecule Viewer
Molecular Orbitals
- 1 -300.33 eV View
- 2 -300.32 eV View
- 3 -300.26 eV View
- 4 -300.26 eV View
- 5 -300.25 eV View
- 6 -300.25 eV View
- 7 -300.19 eV View
- 8 -300.19 eV View
- 9 -300.19 eV View
- 10 -300.19 eV View
- 11 -29.94 eV View
- 12 -28.12 eV View
- 13 -26.89 eV View
- 14 -25.94 eV View
- 15 -25.07 eV View
- 16 -22.22 eV View
- 17 -21.26 eV View
- 18 -21.03 eV View
- 19 -20.04 eV View
- 20 -18.32 eV View
- 21 -16.59 eV View
- 22 -16.49 eV View
- 23 -15.78 eV View
- 24 -15.44 eV View
- 25 -15.02 eV View
- 26 -14.64 eV View
- 27 -14.17 eV View
- 28 -13.39 eV View
- 29 -13.04 eV View
- 30 -12.89 eV View
- 31 -12.84 eV View
- 32 -12.05 eV View
- 33 -12.01 eV View
- 34 -11.51 eV View
- 35 -11.40 eV View
- 36 -11.08 eV View
- 37 -10.19 eV View
- 38 -10.01 eV View
- 39 -9.79 eV View
- 40 14.67 eV View
- 41 15.49 eV View
- 42 15.89 eV View
- 43 16.27 eV View
- 44 16.79 eV View
- 45 17.09 eV View
- 46 17.41 eV View
- 47 17.72 eV View
- 48 18.23 eV View
- 49 18.33 eV View
- 50 18.63 eV View
- 51 18.70 eV View
- 52 19.11 eV View
- 53 19.54 eV View
- 54 20.02 eV View
- 55 20.24 eV View
- 56 20.92 eV View
- 57 20.95 eV View
- 58 21.14 eV View
- 59 21.25 eV View
- 60 21.42 eV View
- 61 21.52 eV View
- 62 22.05 eV View
- 63 22.41 eV View
- 64 22.58 eV View
- 65 22.76 eV View
- 66 22.96 eV View
- 67 23.03 eV View
- 68 23.25 eV View
Vibrational Frequencies
| Vibration |
|
| Vectors |
|
| Balls |
|
- 1 126.41 cm-1 View
- 2 143.11 cm-1 View
- 3 182.25 cm-1 View
- 4 273.21 cm-1 View
- 5 306.51 cm-1 View
- 6 344.57 cm-1 View
- 7 360.73 cm-1 View
- 8 392.05 cm-1 View
- 9 469.97 cm-1 View
- 10 470.18 cm-1 View
- 11 548.89 cm-1 View
- 12 638.18 cm-1 View
- 13 638.65 cm-1 View
- 14 822.83 cm-1 View
- 15 835.45 cm-1 View
- 16 841.50 cm-1 View
- 17 886.09 cm-1 View
- 18 919.77 cm-1 View
- 19 926.59 cm-1 View
- 20 938.42 cm-1 View
- 21 945.77 cm-1 View
- 22 946.03 cm-1 View
- 23 981.35 cm-1 View
- 24 1000.25 cm-1 View
- 25 1023.12 cm-1 View
- 26 1023.87 cm-1 View
- 27 1066.67 cm-1 View
- 28 1070.04 cm-1 View
- 29 1086.52 cm-1 View
- 30 1091.57 cm-1 View
- 31 1096.47 cm-1 View
- 32 1116.35 cm-1 View
- 33 1125.83 cm-1 View
- 34 1144.98 cm-1 View
- 35 1148.55 cm-1 View
- 36 1153.23 cm-1 View
- 37 1155.29 cm-1 View
- 38 1156.88 cm-1 View
- 39 1168.57 cm-1 View
- 40 1187.08 cm-1 View
- 41 1217.00 cm-1 View
- 42 1236.45 cm-1 View
- 43 1249.28 cm-1 View
- 44 1293.29 cm-1 View
- 45 1305.64 cm-1 View
- 46 1325.55 cm-1 View
- 47 1340.11 cm-1 View
- 48 1340.56 cm-1 View
- 49 1359.88 cm-1 View
- 50 1366.61 cm-1 View
- 51 1372.72 cm-1 View
- 52 1389.72 cm-1 View
- 53 1402.65 cm-1 View
- 54 1409.08 cm-1 View
- 55 1409.30 cm-1 View
- 56 1412.59 cm-1 View
- 57 1414.10 cm-1 View
- 58 1415.54 cm-1 View
- 59 1417.80 cm-1 View
- 60 1420.55 cm-1 View
- 61 2853.11 cm-1 View
- 62 2860.94 cm-1 View
- 63 2943.06 cm-1 View
- 64 2946.41 cm-1 View
- 65 2948.95 cm-1 View
- 66 2950.45 cm-1 View
- 67 2956.05 cm-1 View
- 68 2956.94 cm-1 View
- 69 2962.74 cm-1 View
- 70 2964.08 cm-1 View
- 71 3026.65 cm-1 View
- 72 3028.48 cm-1 View
- 73 3029.03 cm-1 View
- 74 3029.57 cm-1 View
- 75 3034.96 cm-1 View
- 76 3036.40 cm-1 View
- 77 3040.82 cm-1 View
- 78 3041.85 cm-1 View
Aqueous Solvation Energy at 298.15 K
| Surface |
|
| Dipole |
|
| Translucent Molecule |
|
| Property | Value | Unit |
| Total Solvation Energy | 24.26 | kJ mol-1 |
| Polar Solvation Energy | -0.83 | kJ mol-1 |
| Nonpolar Solvation Energy | 25.08 | kJ mol-1 |
| Surface Area | 118.39 | Å2 |
| Charge of Molecule | 0 | |
| Dipole | 0.03 | Debye |