(z)-ethene-1,2-diamine (z)-ethene-1,2-diamine
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 | 471.99 | kJ mol-1 |
| Total (Trans. + Rot. + Vib.) | 481.91 | 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 | 135.23 | J mol-1 K-1 |
| Total (Trans. + Rot. + Vib.) | 168.49 | J mol-1 K-1 |
| Entropy | ||
| Property | Value | Unit |
| Translational | 168.04 | J mol-1 K-1 |
| Rotational | 126.09 | J mol-1 K-1 |
| Vibrational | 185.92 | J mol-1 K-1 |
| Total (Trans. + Rot. + Vib.) | 480.05 | J mol-1 K-1 |
| Other Properties | ||
| Property | Value | Unit |
| Heat of Formation | 111.06 | kJ mol-1 |
Molecular Orbitals
- 1 -417.16 eV View
- 2 -417.13 eV View
- 3 -417.06 eV View
- 4 -416.98 eV View
- 5 -300.52 eV View
- 6 -300.50 eV View
- 7 -300.26 eV View
- 8 -300.24 eV View
- 9 -31.57 eV View
- 10 -31.45 eV View
- 11 -30.47 eV View
- 12 -30.32 eV View
- 13 -25.01 eV View
- 14 -24.73 eV View
- 15 -19.60 eV View
- 16 -19.36 eV View
- 17 -18.30 eV View
- 18 -18.08 eV View
- 19 -16.11 eV View
- 20 -15.96 eV View
- 21 -15.87 eV View
- 22 -15.62 eV View
- 23 -13.75 eV View
- 24 -13.62 eV View
- 25 -13.51 eV View
- 26 -12.85 eV View
- 27 -12.07 eV View
- 28 -11.97 eV View
- 29 -10.48 eV View
- 30 -10.26 eV View
- 31 -5.99 eV View
- 32 -5.77 eV View
- 33 9.12 eV View
- 34 9.43 eV View
- 35 14.69 eV View
- 36 15.65 eV View
- 37 16.25 eV View
- 38 17.50 eV View
- 39 18.08 eV View
- 40 18.43 eV View
- 41 18.72 eV View
- 42 19.09 eV View
- 43 19.39 eV View
- 44 19.55 eV View
- 45 20.02 eV View
- 46 20.92 eV View
- 47 21.15 eV View
- 48 21.94 eV View
- 49 25.57 eV View
- 50 25.73 eV View
- 51 27.69 eV View
- 52 28.37 eV View
Vibrational Frequencies
| Vibration |
|
| Vectors |
|
| Balls |
|
- 1 8.34 cm-1 View
- 2 16.44 cm-1 View
- 3 16.76 cm-1 View
- 4 26.18 cm-1 View
- 5 43.71 cm-1 View
- 6 82.70 cm-1 View
- 7 191.96 cm-1 View
- 8 195.16 cm-1 View
- 9 210.66 cm-1 View
- 10 245.62 cm-1 View
- 11 269.18 cm-1 View
- 12 329.76 cm-1 View
- 13 405.83 cm-1 View
- 14 421.86 cm-1 View
- 15 639.25 cm-1 View
- 16 649.20 cm-1 View
- 17 760.95 cm-1 View
- 18 770.03 cm-1 View
- 19 900.17 cm-1 View
- 20 910.20 cm-1 View
- 21 984.39 cm-1 View
- 22 990.35 cm-1 View
- 23 1015.61 cm-1 View
- 24 1022.04 cm-1 View
- 25 1030.58 cm-1 View
- 26 1057.58 cm-1 View
- 27 1061.60 cm-1 View
- 28 1062.55 cm-1 View
- 29 1102.95 cm-1 View
- 30 1110.43 cm-1 View
- 31 1184.06 cm-1 View
- 32 1192.51 cm-1 View
- 33 1195.66 cm-1 View
- 34 1210.97 cm-1 View
- 35 1358.58 cm-1 View
- 36 1361.75 cm-1 View
- 37 1637.53 cm-1 View
- 38 1673.12 cm-1 View
- 39 1675.64 cm-1 View
- 40 1679.66 cm-1 View
- 41 1836.43 cm-1 View
- 42 1841.06 cm-1 View
- 43 2983.06 cm-1 View
- 44 3006.45 cm-1 View
- 45 3013.44 cm-1 View
- 46 3026.30 cm-1 View
- 47 3351.09 cm-1 View
- 48 3376.69 cm-1 View
- 49 3397.37 cm-1 View
- 50 3405.08 cm-1 View
- 51 3500.81 cm-1 View
- 52 3512.98 cm-1 View
- 53 3526.88 cm-1 View
- 54 3532.85 cm-1 View
Aqueous Solvation Energy at 298.15 K
| Surface |
|
| Dipole |
|
| Translucent Molecule |
|
| Property | Value | Unit |
| Total Solvation Energy | -3.52 | kJ mol-1 |
| Polar Solvation Energy | -29.79 | kJ mol-1 |
| Nonpolar Solvation Energy | 26.25 | kJ mol-1 |
| Surface Area | 139.28 | Å2 |
| Charge of Molecule | 0 | |
| Dipole | 2.68 | Debye |