Computational modelling of the enantioselectivity in the asymmetric 1,4-addition of phenylboronic acid to a bulky, doubly pro-chiral maleimide catalyzed by a Rh/chiral diene complex

• Absolute configuration
• Boltzmann distribution
• Computational modelling
• Ligand conformations
• Phenylboronic acids
• Quantitative prediction
• Reaction pathways
• Transition state