C#C.C#C.C#C.C#C.[F-]
Thermodynamics
| Enthalpy |
| Translational | 6.20 | kJ mol-1 |
| Rotational | 3.72 | kJ mol-1 |
| Vibrational | 101.04 | kJ mol-1 |
| Total (Trans. + Rot. + Vib.) | 110.95 | kJ mol-1 |
| Heat Capacity at Constant Pressure |
| Translational | 20.79 | J mol-1 K-1 |
| Rotational | 12.47 | J mol-1 K-1 |
| Vibrational | 111.35 | J mol-1 K-1 |
| Total (Trans. + Rot. + Vib.) | 144.61 | J mol-1 K-1 |
| Entropy |
| Translational | 167.92 | J mol-1 K-1 |
| Rotational | 119.90 | J mol-1 K-1 |
| Vibrational | 113.35 | J mol-1 K-1 |
| Total (Trans. + Rot. + Vib.) | 401.17 | J mol-1 K-1 |
| Other properties |
| Heat of Formation | 3218.21 | kJ mol-1 |
9 4 0 0 0 0 0 0 0 0999 V2000
-2.5387 -0.8635 0.4972 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.9162 0.9263 0.8504 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.1383 -0.5516 0.9249 F 0 0 0 0 0 0 0 0 0 0 0 0
-0.7374 2.1205 0.7916 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.7717 -1.3894 3.4705 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.6699 -1.1145 0.1524 C 0 0 0 0 0 0 0 0 0 0 0 0
0.6082 -1.8094 -0.7125 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.1732 -1.2475 0.0192 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.9349 -1.0159 2.3324 C 0 0 0 0 0 0 0 0 0 0 0 0
2 4 3 0
1 6 3 0
9 5 3 0
8 7 3 0
M CHG 1 3 -1
M END