CC1=CC2C(CC1)C(C)CCC2C(C)C(=O)O
Predicted BDE: 111.6 kcal/mol
Similar DFT-Calculated Bonds
O=C(O)[C@@H]1CC/C(=N\O)C1
BDE(DFT): 112.5 kcal/molDistance: 0.03
O=C1CC[C@H](C(=O)O)C1
BDE(DFT): 112.3 kcal/molDistance: 0.03
O=C(O)[C@@H]1CC[C@@H]2O[C@@H]2C1
BDE(DFT): 112.8 kcal/molDistance: 0.03
CCC(C)(CC)C(=O)O
BDE(DFT): 111.5 kcal/molDistance: 0.04
NC[C@H](CC(=O)O)C(=O)O
BDE(DFT): 111.4 kcal/molDistance: 0.05
CC[C@H](C(=O)O)C(C)(C)C
BDE(DFT): 112.2 kcal/molDistance: 0.05
O=C(O)C12CC(CF)(C1)C2
BDE(DFT): 111.9 kcal/molDistance: 0.06
CNC(=O)[C@H](C)C(=O)O
BDE(DFT): 112.0 kcal/molDistance: 0.06
C=C[C@H](O)CC(=O)O
BDE(DFT): 112.4 kcal/molDistance: 0.06
O=C[C@H](O)CC(=O)O
BDE(DFT): 113.2 kcal/molDistance: 0.06