Synthesis and multidimensional investigation of a tetra-substituted imidazole derivative: Spectroscopy, DFT/NLO properties, toxicity analysis, molecular docking, and dynamics simulation
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A novel tetra-substituted imidazole derivative (BDIM) was synthesized via a one-pot, four-component condensation reaction using BF3 as a Lewis acid catalyst. The experimental FT-IR,1H- and 1³C-NMR spectra show a very good match with the DFT-calculated results... ...
