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Volumn 1060, Issue 1, 2014, Pages 215-222

Synthesis, characterization and theoretical study of new hetarylazopyrazolone dyes and investigation of their absorption spectra

(3) Aktan, Ebru a Ertan, Nermin a Uyar, Tahsin a

a GAZI UNIVERSITY (Turkey)

Author keywords

DFT; Hetarylazopyrazolone dyes; Solvatochromic behaviour; Substituent effect; Tautomerism; TD DFT IEFPCM

Indexed keywords

AMINES; CONTINUUM MECHANICS; DYES; ELECTROMAGNETIC WAVE ABSORPTION; GROUND STATE; INTEGRAL EQUATIONS;

INTEGRAL EQUATION FORMALISMS; POLARIZABLE CONTINUUM MODEL; SOLVATOCHROMIC; SOLVATOCHROMIC PROPERTIES; SUBSTITUENT EFFECT; TAUTOMERISM; TD-DFT/IEFPCM; TIME DEPENDENT DENSITY FUNCTIONAL THEORY;

DENSITY FUNCTIONAL THEORY;

EID: 84892688090 PISSN: 00222860 EISSN: None Source Type: Journal
DOI: 10.1016/j.molstruc.2013.12.015 Document Type: Article

Times cited : (15)

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