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. 2020 Nov 16;26(12):341. doi: 10.1007/s00894-020-04603-1

Table 3.

Electronic transitions in tucatinib

No. Wavelength (nm) Osc. Strength Symmetry Major contributions
1 309.24 0.44 Singlet-A HOMO → LUMO (90%)
2 267.56 0.26 Singlet-A H-2 → LUMO (12%), HOMO → L + 2 (60%)
3 265.44 0.0032 Singlet-A H-6 → LUMO (84%)