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. 2005 Jun 22;127(24):8594-5.
doi: 10.1021/ja050880n.

Electrostatic control of aromatic stacking interactions

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Electrostatic control of aromatic stacking interactions

Scott L Cockroft et al. J Am Chem Soc. .

Abstract

A supramolecular approach has been used to investigate the free energies of intermolecular aromatic stacking interactions. Chemical double mutant cycles have been used to measure the effect of a range of substituents on face-to-face stacking interactions with phenyl and pentafluorophenyl rings. Electrostatic effects dominate the trends in interaction energy.

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