O=Cl(=O)N(Cl)Cl
Thermodynamics
| Enthalpy |
| Translational | 6.20 | kJ mol-1 |
| Rotational | 3.72 | kJ mol-1 |
| Vibrational | 53.14 | kJ mol-1 |
| Total (Trans. + Rot. + Vib.) | 63.05 | 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 | 59.93 | J mol-1 K-1 |
| Total (Trans. + Rot. + Vib.) | 93.19 | J mol-1 K-1 |
| Entropy |
| Translational | 171.31 | J mol-1 K-1 |
| Rotational | 119.77 | J mol-1 K-1 |
| Vibrational | 70.54 | J mol-1 K-1 |
| Total (Trans. + Rot. + Vib.) | 361.62 | J mol-1 K-1 |
| Other properties |
| Heat of Formation | -285.73 | kJ mol-1 |
6 5 0 0 0 0 0 0 0 0999 V2000
-0.6756 0.1738 -0.2577 N 0 0 0 0 0 0 0 0 0 0 0 0
0.9090 -0.2078 0.3326 Cl 0 0 0 0 0 0 0 0 0 0 0 0
1.7207 0.9127 0.4525 O 0 0 0 0 0 0 0 0 0 0 0 0
1.5152 -1.2300 -0.3859 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.5635 -0.8617 -1.2826 Cl 0 0 0 0 0 0 0 0 0 0 0 0
-1.3307 1.7491 -0.2307 Cl 0 0 0 0 0 0 0 0 0 0 0 0
1 2 1 0
3 2 2 0
4 2 2 0
5 1 1 0
6 1 1 0
M END