III.G.10.b. |
Bond Length differences between CCSD(T) (frozen core) and CCSD(T)=FULL (all electrons correlated)
Choose the bonds for CH3CF2Cl (1-Chloro-1,1-Difluoroethane)Species | Name | Level |
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CH3CF2Cl | 1-Chloro-1,1-Difluoroethane | HF/6-31G* |
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