Synthesis, solvent role (water and DMSO), antimicrobial activity, reactivity analysis, inter and intramolecular charge transfer, topology, and molecular docking studies on adenine derivative
N. Elangovan, S. Sowrirajan, Natarajan Arumugam, Abdulrahman I. Almansour, Sakkarapalayam M. Mahalingam, S. Kanchana
Topics & Concepts
ChemistryNatural bond orbitalPolarizable continuum modelBasis setPolarizabilityHOMO/LUMOSolvationHydrogen bondIntramolecular forceComputational chemistryMoleculeAcceptorInteraction energyDensity functional theoryStereochemistryOrganic chemistryPhysicsCondensed matter physicsNonlinear Optical Materials ResearchSynthesis and Characterization of Heterocyclic CompoundsSynthesis and biological activity