Molecular interactions between pillar[5]arene and bis(pyridinium) derivatives

Article ID	Journal	Published Year	Pages	File Type
5394493	Computational and Theoretical Chemistry	2012	10 Pages	PDF

Abstract

âº Electron-rich regions are largely localized near the flipped hydroquinone monomers. âº Host-guest binding pattern depends on alkyl chain-length of bis(pyridinium) guest. âº Hydrogen bonding interactions govern the stability of the complex. âº Solvent has profound influence on conformational energies of the complex.

Keywords

Pillar[5]arene Density functional theory Molecular electrostatic potential

Related Topics

Physical Sciences and Engineering Chemistry Physical and Theoretical Chemistry

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Molecular interactions between pillar[5]arene and bis(pyridinium) derivatives

Authors

Swarada R. Peerannawar, Shridhar P. Gejji,