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- W1989734505 abstract "The INDO method was used to calculate electronic charge densities in the ground and lowest excited singlet and triplet states of neutral and protonated 2,3- and 1,4-diaza derivatives of naphthalene and phenanthrene, and benzo (a) phenazine. Experiniental changes of pKa upon excitation can be correlated with the values of electron density flow into the heterocy- clic ring. Electron-density increase turns out to be a major factor which causes distortion in some excited protonated species." @default.
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- W1989734505 date "1980-02-01" @default.
- W1989734505 modified "2023-10-17" @default.
- W1989734505 title "Charge density flow as a driving force of distortion in excited protonated azaaromatics" @default.
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- W1989734505 doi "https://doi.org/10.1016/0009-2614(80)80088-1" @default.
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