ECD Simulation Prediction

Many natural compound molecules in nature have optical chirality. Correctly determining the three-dimensional configuration of an organic compound molecule is a work that organic chemists, especially drug researchers, cannot ignore. Electrostatic circular dichroism (ECD) is very sensitive to the spatial orientation of molecular groups and can provide information on the three-dimensional structure of chiral molecules. It has become a powerful tool for exploring the absolute configuration of chiral molecules in space.