A Theoretical Study of the Relationships between Electronic Structure and CB1 and CB2 Cannabinoid Receptor Binding Affinity in a Group of 1-Aryl-5-(1-H-pyrrol-1-yl)-1-H-pyrazole-3-carboxamides
Figure 2
Molecular orbitals and electronic populations (Fukui indices). H means HOMO (the highest occupied MO), the next upper occupied MO, the second next upper occupied MO, L the LUMO (the lowest unoccupied MO), the second lowest unoccupied MO, and the third lowest unoccupied MO. The circles depict those MOs in which an atom has a nonzero electron population.
