Colorimetric and DFT-Supported optical sensing of mercuric (Hg2+) ions using a schiff base derived from p-Dimethylaminobenzaldehyde
摘要
These days, optical sensors are getting considerable interest of researchers due to their portability and rapid on-site detection abilities for metal ions. In this paper, a Schiff base 2-((4-(dimethylamino)benzylidene)amino)acetic acid (DMAB-G) was studied for its optical sensing properties towards metals ions i.e. Al3+, Mn2+, Fe2+, Fe3+, Co2+, Ni2+, Cu2+, Zn2+, Ag+, Cd2+, Hg2+, Pb2+, AsO2− and La3+. This naked eye probe showed a selective color change from colorless to pale yellow only for mercuric (Hg2+) ions which is consistent with red shift from 342 nm to 448 nm having an LOD of 1.71 × 10− 6 M in aqueous medium which make it better sensor compared to literature reported ones. Furthermore, calculations revealed a DMAB-G bound with Hg2+ ions in a ratio of 2:1 with an association constant of 1.7 × 103 M− 2. FT-IR data suggested that DMAB-G interacted with mercuric ions by coordination through nitrogen of imine group and carbonyl of carboxyl moieties which was further confirmed by DFT-Calculations.
Graphical abstract