Evaluation of electronic properties in different solvents, spectroscopic exposition (FT-IR, FT-Raman), and molecular docking studies of 5-Chloro-2-hydroxypyridine - insulysin inhibitor
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DOI: 10.1016/j.molliq.2021.117304
Abstract: Abstract In the current work, the experimental and theoretical reports on the upgraded geometrical structure, electronic and vibrational features of 5-chloro-2-hydroxypyridine are presented assigning B3LYP method with 6-311++G (d, p) basis set. The FT-IR and… read more here.
Keywords: molecular docking; electronic properties; energy; evaluation electronic ... See more keywords