Ethenamine
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 | 181.14 | kJ mol-1 |
| Total (Trans. + Rot. + Vib.) | 191.06 | 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 | 27.54 | J mol-1 K-1 |
| Total (Trans. + Rot. + Vib.) | 60.79 | J mol-1 K-1 |
| Entropy | ||
| Property | Value | Unit |
| Translational | 155.67 | J mol-1 K-1 |
| Rotational | 91.06 | J mol-1 K-1 |
| Vibrational | 13.62 | J mol-1 K-1 |
| Total (Trans. + Rot. + Vib.) | 260.35 | J mol-1 K-1 |
| Other Properties | ||
| Property | Value | Unit |
| Heat of Formation | 58.73 | kJ mol-1 |
Molecular Orbitals
- 1 -417.24 eV View
- 2 -301.04 eV View
- 3 -299.01 eV View
- 4 -31.19 eV View
- 5 -25.55 eV View
- 6 -19.99 eV View
- 7 -17.39 eV View
- 8 -15.61 eV View
- 9 -14.09 eV View
- 10 -12.76 eV View
- 11 -11.58 eV View
- 12 -7.06 eV View
- 13 9.12 eV View
- 14 16.12 eV View
- 15 17.41 eV View
- 16 19.18 eV View
- 17 19.54 eV View
- 18 20.46 eV View
- 19 25.51 eV View
- 20 27.89 eV View
Vibrational Frequencies
| Vibration |
|
| Vectors |
|
| Balls |
|
- 1 284.11 cm-1 View
- 2 484.84 cm-1 View
- 3 615.80 cm-1 View
- 4 908.84 cm-1 View
- 5 945.78 cm-1 View
- 6 975.89 cm-1 View
- 7 1010.35 cm-1 View
- 8 1057.88 cm-1 View
- 9 1172.85 cm-1 View
- 10 1269.00 cm-1 View
- 11 1346.19 cm-1 View
- 12 1663.72 cm-1 View
- 13 1828.07 cm-1 View
- 14 3013.01 cm-1 View
- 15 3142.12 cm-1 View
- 16 3157.93 cm-1 View
- 17 3406.04 cm-1 View
- 18 3530.26 cm-1 View
Aqueous Solvation Energy at 298.15 K
| Surface |
|
| Dipole |
|
| Translucent Molecule |
|
| Property | Value | Unit |
| Total Solvation Energy | 2.80 | kJ mol-1 |
| Polar Solvation Energy | -8.32 | kJ mol-1 |
| Nonpolar Solvation Energy | 11.12 | kJ mol-1 |
| Surface Area | 66.06 | Å2 |
| Charge of Molecule | 0 | |
| Dipole | 1.37 | Debye |