Skip to main content
Draw

CCCc1ccccc1C(=O)c1ccccc1

Predicted BDE: 110.8 kcal/mol

Similar DFT-Calculated Bonds

CCSCc1ccccc1

BDE(DFT): 110.6 kcal/mol
Distance: 0.07

C[C@H](N)Cc1ccccc1

BDE(DFT): 110.6 kcal/mol
Distance: 0.07

c1ccc(C23CC2C3)cc1

BDE(DFT): 110.5 kcal/mol
Distance: 0.07

NCc1ccccc1CO

BDE(DFT): 110.6 kcal/mol
Distance: 0.08

C[C@H](O)Cc1ccccc1

BDE(DFT): 110.8 kcal/mol
Distance: 0.10

C=C[C@H](N)c1ccccc1

BDE(DFT): 110.9 kcal/mol
Distance: 0.10