(2s)-2-(chloromethyl)oxirane
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 | 202.50 | kJ mol-1 |
| Total (Trans. + Rot. + Vib.) | 212.41 | 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 | 48.89 | J mol-1 K-1 |
| Total (Trans. + Rot. + Vib.) | 82.14 | J mol-1 K-1 |
| Entropy | ||
| Property | Value | Unit |
| Translational | 165.14 | J mol-1 K-1 |
| Rotational | 109.92 | J mol-1 K-1 |
| Vibrational | 42.53 | J mol-1 K-1 |
| Total (Trans. + Rot. + Vib.) | 317.59 | J mol-1 K-1 |
| Other Properties | ||
| Property | Value | Unit |
| Heat of Formation | -79.40 | kJ mol-1 |
Molecular Orbitals
- 1 -2819.30 eV View
- 2 -552.49 eV View
- 3 -302.69 eV View
- 4 -302.56 eV View
- 5 -302.20 eV View
- 6 -280.59 eV View
- 7 -211.00 eV View
- 8 -210.85 eV View
- 9 -210.85 eV View
- 10 -37.19 eV View
- 11 -29.35 eV View
- 12 -24.85 eV View
- 13 -23.51 eV View
- 14 -21.26 eV View
- 15 -17.95 eV View
- 16 -16.76 eV View
- 17 -15.50 eV View
- 18 -14.25 eV View
- 19 -13.78 eV View
- 20 -12.31 eV View
- 21 -10.54 eV View
- 22 -10.43 eV View
- 23 -9.92 eV View
- 24 -9.76 eV View
- 25 9.93 eV View
- 26 12.11 eV View
- 27 15.68 eV View
- 28 16.03 eV View
- 29 17.17 eV View
- 30 17.77 eV View
- 31 18.21 eV View
- 32 18.64 eV View
- 33 21.44 eV View
- 34 22.17 eV View
Vibrational Frequencies
| Vibration |
|
| Vectors |
|
| Balls |
|
- 1 46.22 cm-1 View
- 2 231.20 cm-1 View
- 3 384.73 cm-1 View
- 4 391.03 cm-1 View
- 5 725.46 cm-1 View
- 6 846.49 cm-1 View
- 7 856.52 cm-1 View
- 8 909.21 cm-1 View
- 9 955.66 cm-1 View
- 10 1010.69 cm-1 View
- 11 1053.07 cm-1 View
- 12 1114.82 cm-1 View
- 13 1150.13 cm-1 View
- 14 1165.69 cm-1 View
- 15 1210.35 cm-1 View
- 16 1260.12 cm-1 View
- 17 1348.26 cm-1 View
- 18 1382.53 cm-1 View
- 19 1598.46 cm-1 View
- 20 2953.57 cm-1 View
- 21 3003.17 cm-1 View
- 22 3040.62 cm-1 View
- 23 3056.73 cm-1 View
- 24 3060.47 cm-1 View
Aqueous Solvation Energy at 298.15 K
| Surface |
|
| Dipole |
|
| Translucent Molecule |
|
| Property | Value | Unit |
| Total Solvation Energy | 0.00 | kJ mol-1 |
| Polar Solvation Energy | 0.00 | kJ mol-1 |
| Nonpolar Solvation Energy | 0.00 | kJ mol-1 |
| Surface Area | Å2 | |
| Charge of Molecule | 0 | |
| Dipole | 0.00 | Debye |