engleski

Extending Acidity Ladder of Neutral Organic Superacids - A DFT-B3LYP Study of Deprotonation of Nonacyanofluorene

It is shown by a carefully selected B3LYP/6-311+G(2d, p)//B3LYP/6-31G(d) model that nonacyanofluorene and its most stable prototropic tautomer represent very powerful neutral organic acids in spe (in hopes) both in the gas phase and in DMSO.

acidity; anionic resonance; aromaticity; polarized continuum model; superacids

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