Experimental and density functional theory studies on (E)-2-[(2-(hydroxymethyl)phenylimino)methyl]benzene-1,4-diol
Yelda Bingöl Alpaslan, Gökhan Alpaslan, Ayşen Alaman Ağar, N.O. Iskeleli, Emin Öztekin
Abstract
Yelda Bingöl Alpaslan, Gökhan Alpaslan, Ayşen Alaman Ağar, N.O. Iskeleli, Emin Öztekin
Abstract
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Key concepts: Chemistry, Natural bond orbital, Polarizable continuum model, Density functional theory, Basis set, Polarizability, Hydroxymethyl, Molecular geometry