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Analysis of boronic acids containing amino ferrocene by DFT approach and in silico studies

Muhammad, U. S.; Erkan Sultan; Kaya,Savaş (Elsevier, 2023)

The synthesized (2)-(6) complexes and (2′)-(6′) hypothetical complexes formed by attached boranic acid esters were optimized at the DFT-B3LYP/GEN level. The structural and spectroscopic properties (IR, 1HNMR , 13CNMR ) of ...