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Spectra of biipo (black) and Rubiipo (orange). Top) UV/Vis absorption spectrum in acetonitrile. Middle) Calculated absorption spectrum of Rubiipo resulting from the convolution (std. deviation 40) of the transitions above 290 nm (vertical bars) with a Gaussian function. The transition energies are calculated at full TD‐DFT level of theory (B3LYP‐D3(BJ)/def2‐TZVP. Bottom) Emission spectra in acetonitrile under oxygen‐free conditions.
