Molecular structure, electronic properties, ESP map (polar aprotic and polar protic solvents), and topology investigations on 1-(tert‑Butoxycarbonyl)-3-piperidinecarboxylic acid- Anticancer therapeutic agent
S. Janani, Hemamalini Rajagopal, S. Sakthivel, S. Aayisha, M. Raja, Ahmad Irfan, Saleem Javed, S. Muthu
Topics & Concepts
ChemistryPolarElectrophileHOMO/LUMOSolventComputational chemistryMoleculeTopology (electrical circuits)Basis setNucleophileCombinatorial chemistryDensity functional theoryOrganic chemistryMathematicsPhysicsAstronomyCombinatoricsCatalysisComputational Drug Discovery MethodsFree Radicals and AntioxidantsSynthesis and biological activity