Bromoethyne
Molecule Viewer
Thermodynamics at 298.15 K and standard pressure
| Enthalpy | ||
| Property | Value | Unit |
| Translational | 6.20 | kJ mol-1 |
| Rotational | 2.48 | kJ mol-1 |
| Vibrational | 54.09 | kJ mol-1 |
| Total (Trans. + Rot. + Vib.) | 62.77 | kJ mol-1 |
| Heat Capacity at Constant Pressure | ||
| Property | Value | Unit |
| Translational | 20.79 | J mol-1 K-1 |
| Rotational | 8.31 | J mol-1 K-1 |
| Vibrational | 22.54 | J mol-1 K-1 |
| Total (Trans. + Rot. + Vib.) | 51.64 | J mol-1 K-1 |
| Entropy | ||
| Property | Value | Unit |
| Translational | 166.66 | J mol-1 K-1 |
| Rotational | 69.30 | J mol-1 K-1 |
| Vibrational | 13.59 | J mol-1 K-1 |
| Total (Trans. + Rot. + Vib.) | 249.55 | J mol-1 K-1 |
| Other Properties | ||
| Property | Value | Unit |
| Heat of Formation | 291.87 | kJ mol-1 |
Molecular Orbitals
- 1 -13193.52 eV View
- 2 -1735.61 eV View
- 3 -1575.92 eV View
- 4 -1575.86 eV View
- 5 -1575.86 eV View
- 6 -300.10 eV View
- 7 -299.48 eV View
- 8 -252.27 eV View
- 9 -189.56 eV View
- 10 -189.17 eV View
- 11 -189.17 eV View
- 12 -64.02 eV View
- 13 -63.87 eV View
- 14 -63.87 eV View
- 15 -63.49 eV View
- 16 -63.49 eV View
- 17 -27.46 eV View
- 18 -24.43 eV View
- 19 -18.15 eV View
- 20 -14.33 eV View
- 21 -11.76 eV View
- 22 -11.76 eV View
- 23 -8.37 eV View
- 24 -8.37 eV View
- 25 9.90 eV View
- 26 10.73 eV View
- 27 10.73 eV View
- 28 17.61 eV View
- 29 38.79 eV View
- 30 2907.23 eV View
Vibrational Frequencies
| Vibration |
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| Vectors |
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| Balls |
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Aqueous Solvation Energy at 298.15 K
| Surface |
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| Dipole |
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| Translucent Molecule |
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| 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 |