The DO1(18c6)fi (MwLi. Na. K and I 8c6=18-crown-6) complexes have been chosen as the model systems toinvestigate the nature of chemical bonds between alkali metal cations and large mffitidentaie orgmnic ligands.The B3LYP/6-3I+G(d,p) level of calculation has been used for obtaining equilibrium geernetnes and p(r)functions (electron density distributions). By the aid of fundamental physical theor...

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A series of Schiff Bases of Ni(II) and Cu(II) using acetylacetone (acac), salicylaldehyde (sal), ethylenediamine (en), and o-phenylendiarnine (dabe) were prepared and characterized. The electronic spectra of some copper chelates in various organic solvents depend strongly on the solvent used and the d-d band of Cu(II) shifts to red with the increase of the Donor Number (DN) of solvent. The ...