Levofloxacin capped Ag-nanoparicles: A new highly selective sensor for cations under joint experimental and DFT investigation.

A very new and alternate function of an antibiotic drug levofloxacin (Lv), as a highly selective, colorimetric turn-OFF/turn-ON chemosensor for metal-ions Hg and Fe, has been reported in this study. An extremely easy, very less time consuming, economical one-pot method of synthesis has been developed for the production of silver nanoparticles (AgNPs). The AgNPs that are stabilized and surface functionalized by Lv. Functionalization of AgNPs by antibiotic drug Lv has been thoroughly confirmed using FTIR spectrophotometry. Two carbonyl oxygen moieties, one belongs to the pyridine oxygen group and another one from the carboxylate oxygen group of Lv together form the binding site over the nanoparticle surface. The Lv-AgNPs system has shown naked eye detectable colour change, as well as significant change via both UV-Vis and fluorescence spectroscopy. The limits of detection (LODs) are predicted to be 6.86×10M for Hg and 2.52×10M for Fe using UV-Vis spectroscopy and 2.35×10M for Fe using fluorescence spectroscopy. UV-Vis spectroscopy, fluorescence spectroscopy, FTIR, TEM, DLS etc. have been used for the physico-chemical characterization of Lv-AgNPs system and the nanoparticle mediated sensing process. Detailed experimental and theoretical studies employing FTIR spectrophotometry and density functional theory (DFT) studies have been used for the elucidation of drug-nanoparticle based sensing mechanism. It is also demonstrated that the Lv-AgNPs system can show real time application using Test-Paper Kit to establish the drug-nanoparticle assembly as a potential colorimetric turn-OFF/turn-ON sensing system for Hg and Fe respectively.