1-chloro-4-fluorobenzene
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 | 227.27 | kJ mol-1 |
| Total (Trans. + Rot. + Vib.) | 237.19 | 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 | 74.45 | J mol-1 K-1 |
| Total (Trans. + Rot. + Vib.) | 107.71 | J mol-1 K-1 |
| Entropy | ||
| Property | Value | Unit |
| Translational | 169.45 | J mol-1 K-1 |
| Rotational | 119.90 | J mol-1 K-1 |
| Vibrational | 49.60 | J mol-1 K-1 |
| Total (Trans. + Rot. + Vib.) | 338.95 | J mol-1 K-1 |
| Other Properties | ||
| Property | Value | Unit |
| Heat of Formation | -111.44 | kJ mol-1 |
Vibrational Frequencies
| Vibration |
|
| Vectors |
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| Balls |
|
- 1 115.51 cm-1 View
- 2 261.63 cm-1 View
- 3 315.45 cm-1 View
- 4 362.32 cm-1 View
- 5 371.94 cm-1 View
- 6 458.58 cm-1 View
- 7 510.69 cm-1 View
- 8 643.15 cm-1 View
- 9 643.23 cm-1 View
- 10 666.10 cm-1 View
- 11 846.59 cm-1 View
- 12 874.31 cm-1 View
- 13 904.56 cm-1 View
- 14 978.94 cm-1 View
- 15 993.80 cm-1 View
- 16 1045.30 cm-1 View
- 17 1122.13 cm-1 View
- 18 1150.21 cm-1 View
- 19 1166.16 cm-1 View
- 20 1211.58 cm-1 View
- 21 1306.74 cm-1 View
- 22 1446.43 cm-1 View
- 23 1538.27 cm-1 View
- 24 1674.88 cm-1 View
- 25 1763.99 cm-1 View
- 26 1810.71 cm-1 View
- 27 3057.02 cm-1 View
- 28 3058.63 cm-1 View
- 29 3072.46 cm-1 View
- 30 3075.86 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 |