CC1=CC2C(CC1)C(C)CCC2C(C)C(=O)O
Predicted BDE: 96.2 kcal/mol
Similar DFT-Calculated Bonds
C[C@@H]1CCCC(C)(C)[C@@H]1C
BDE(DFT): 96.3 kcal/molDistance: 0.23
C1C[C@@H]2C[C@@H]3[C@H](C1)CC[C@H]23
BDE(DFT): 96.2 kcal/molDistance: 0.24
O=C1CC[C@@H]2CCC[C@@H]2C1
BDE(DFT): 96.3 kcal/molDistance: 0.26
CCCCCNC(N)=S
BDE(DFT): 96.0 kcal/molDistance: 0.27
CC1(C)CC[C@@H]1CCO
BDE(DFT): 96.6 kcal/molDistance: 0.27