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. 2021 Nov 18;11(59):37181–37193. doi: 10.1039/d1ra05737e

Molecular orbitals and maps of electron density differences between the states involved in the electronic transition of absorption located at 393–398 nm for R1 to R4 (yellow: density reduction; and green: density increment due to the transition).

Complex HOMO LUMO+1 Density diff.
R1 graphic file with name d1ra05737e-u1.jpg graphic file with name d1ra05737e-u2.jpg graphic file with name d1ra05737e-u3.jpg
R2 graphic file with name d1ra05737e-u4.jpg graphic file with name d1ra05737e-u5.jpg graphic file with name d1ra05737e-u6.jpg
R3 graphic file with name d1ra05737e-u7.jpg graphic file with name d1ra05737e-u8.jpg graphic file with name d1ra05737e-u9.jpg
R4 graphic file with name d1ra05737e-u10.jpg graphic file with name d1ra05737e-u11.jpg graphic file with name d1ra05737e-u12.jpg