ethane
Molecule Viewer
Thermodynamics at 298.15 K and standard pressure
| Enthalpy | ||
| Property | Value | Unit |
| Translational | 6.20 | kJ mol-1 |
| Rotational | 3.72 | kJ mol-1 |
| Vibrational | 591.06 | kJ mol-1 |
| Total (Trans. + Rot. + Vib.) | 600.97 | kJ mol-1 |
| Heat Capacity at Constant Pressure | ||
| Property | Value | Unit |
| Translational | 20.79 | J mol-1 K-1 |
| Rotational | 12.47 | J mol-1 K-1 |
| Vibrational | 158.25 | J mol-1 K-1 |
| Total (Trans. + Rot. + Vib.) | 191.51 | J mol-1 K-1 |
| Entropy | ||
| Property | Value | Unit |
| Translational | 170.30 | J mol-1 K-1 |
| Rotational | 131.53 | J mol-1 K-1 |
| Vibrational | 239.54 | J mol-1 K-1 |
| Total (Trans. + Rot. + Vib.) | 541.36 | J mol-1 K-1 |
| Other Properties | ||
| Property | Value | Unit |
| Heat of Formation | 737.04 | kJ mol-1 |
Molecular Orbitals
- 1 -428.35 eV View
- 2 -424.75 eV View
- 3 -309.15 eV View
- 4 -309.10 eV View
- 5 -308.03 eV View
- 6 -307.92 eV View
- 7 -307.91 eV View
- 8 -305.47 eV View
- 9 -302.27 eV View
- 10 -302.02 eV View
- 11 -41.28 eV View
- 12 -38.24 eV View
- 13 -33.55 eV View
- 14 -32.71 eV View
- 15 -29.58 eV View
- 16 -28.91 eV View
- 17 -28.62 eV View
- 18 -27.21 eV View
- 19 -24.48 eV View
- 20 -23.77 eV View
- 21 -23.76 eV View
- 22 -22.91 eV View
- 23 -22.34 eV View
- 24 -21.64 eV View
- 25 -21.12 eV View
- 26 -20.25 eV View
- 27 -19.48 eV View
- 28 -18.75 eV View
- 29 -18.24 eV View
- 30 -17.72 eV View
- 31 -17.35 eV View
- 32 -17.34 eV View
- 33 -16.15 eV View
- 34 -15.28 eV View
- 35 -14.97 eV View
- 36 -14.54 eV View
- 37 -14.12 eV View
- 38 -14.12 eV View
- 39 -1.56 eV View
- 40 0.29 eV View
- 41 5.87 eV View
- 42 7.37 eV View
- 43 9.22 eV View
- 44 9.55 eV View
- 45 11.18 eV View
- 46 11.53 eV View
- 47 11.74 eV View
- 48 12.10 eV View
- 49 13.16 eV View
- 50 13.55 eV View
- 51 15.35 eV View
- 52 15.40 eV View
- 53 15.44 eV View
- 54 15.45 eV View
- 55 15.84 eV View
- 56 16.12 eV View
- 57 16.81 eV View
- 58 17.06 eV View
- 59 17.79 eV View
- 60 18.04 eV View
- 61 19.14 eV View
- 62 19.46 eV View
- 63 19.47 eV View
- 64 21.11 eV View
- 65 21.66 eV View
Vibrational Frequencies
| Vibration |
|
| Vectors |
|
| Balls |
|
- 1 10.29 cm-1 View
- 2 11.59 cm-1 View
- 3 18.34 cm-1 View
- 4 22.69 cm-1 View
- 5 25.45 cm-1 View
- 6 69.17 cm-1 View
- 7 73.35 cm-1 View
- 8 159.55 cm-1 View
- 9 236.41 cm-1 View
- 10 247.13 cm-1 View
- 11 298.26 cm-1 View
- 12 346.58 cm-1 View
- 13 413.63 cm-1 View
- 14 467.19 cm-1 View
- 15 565.04 cm-1 View
- 16 641.37 cm-1 View
- 17 647.97 cm-1 View
- 18 806.97 cm-1 View
- 19 823.60 cm-1 View
- 20 850.98 cm-1 View
- 21 876.36 cm-1 View
- 22 880.55 cm-1 View
- 23 881.13 cm-1 View
- 24 987.55 cm-1 View
- 25 994.30 cm-1 View
- 26 1003.60 cm-1 View
- 27 1021.50 cm-1 View
- 28 1030.64 cm-1 View
- 29 1071.09 cm-1 View
- 30 1083.58 cm-1 View
- 31 1107.82 cm-1 View
- 32 1121.23 cm-1 View
- 33 1121.89 cm-1 View
- 34 1125.17 cm-1 View
- 35 1129.77 cm-1 View
- 36 1138.14 cm-1 View
- 37 1147.69 cm-1 View
- 38 1187.94 cm-1 View
- 39 1240.04 cm-1 View
- 40 1285.05 cm-1 View
- 41 1344.56 cm-1 View
- 42 1358.02 cm-1 View
- 43 1383.00 cm-1 View
- 44 1396.14 cm-1 View
- 45 1407.19 cm-1 View
- 46 1407.55 cm-1 View
- 47 1413.65 cm-1 View
- 48 1414.41 cm-1 View
- 49 1416.70 cm-1 View
- 50 1442.70 cm-1 View
- 51 1446.96 cm-1 View
- 52 1539.42 cm-1 View
- 53 1688.94 cm-1 View
- 54 1713.16 cm-1 View
- 55 2905.65 cm-1 View
- 56 2910.26 cm-1 View
- 57 2967.20 cm-1 View
- 58 2971.78 cm-1 View
- 59 2982.36 cm-1 View
- 60 2988.40 cm-1 View
- 61 3040.75 cm-1 View
- 62 3074.00 cm-1 View
- 63 3074.86 cm-1 View
- 64 3075.27 cm-1 View
- 65 3088.59 cm-1 View
- 66 3089.06 cm-1 View
- 67 3160.51 cm-1 View
- 68 3181.64 cm-1 View
- 69 3186.15 cm-1 View
Aqueous Solvation Energy at 298.15 K
| Surface |
|
| Dipole |
|
| Translucent Molecule |
|
| Property | Value | Unit |
| Total Solvation Energy | -76.08 | kJ mol-1 |
| Polar Solvation Energy | -200.45 | kJ mol-1 |
| Nonpolar Solvation Energy | 124.36 | kJ mol-1 |
| Surface Area | 153.77 | Å2 |
| Charge of Molecule | 1 | |
| Dipole | 10.60 | Debye |