Zeynep Demi̇rci̇oğlu

Theoretical analysis (NBO, NPA, Mulliken Population Method) and molecular orbital studies (hardness, chemical potential, electrophilicity and Fukui function analysis) of (E)-2-((4-hydroxy-2-methylphenylimino)methyl)-3-methoxyphenol

Zeynep Demi̇rci̇oğlu, Orhan Büyükgüngör · Journal of Molecular Structure · 2015 · 325 citations

Natural Sciences, Chemistry, Computational Chemistry +6

The spectroscopic (FT-IR, UV–vis), Fukui function, NLO, NBO, NPA and tautomerism effect analysis of (E)-2-[(2-hydroxy-6-methoxybenzylidene)amino]benzonitrile

Zeynep Demi̇rci̇oğlu, Orhan Büyükgüngör · Spectrochimica Acta Part A Molecular and Biomolecular Spectroscopy · 2014 · 136 citations

Natural Sciences, Chemistry, Organic Chemistry +11

Spectroscopic, XRD, Hirshfeld surface and DFT approach (chemical activity, ECT, NBO, FFA, NLO, MEP, NPA& MPA) of (E)-4-bromo-2-[(4-bromophenylimino)methyl]-6-ethoxyphenol

Zeynep Demi̇rci̇oğlu, Gökhan Kaştaş, Ç. Albayrak et al. · Journal of Molecular Structure · 2019 · 90 citations

Natural Sciences, Chemistry, Materials Science +7

Theoretical and experimental investigation of (E)-2-([3,4-dimethylphenyl)imino]methyl)-3-methoxyphenol: Enol–keto tautomerism, spectroscopic properties, NLO, NBO and NPA analysis

Zeynep Demi̇rci̇oğlu, Ç. Albayrak, Orhan Büyükgüngör · Journal of Molecular Structure · 2014 · 58 citations

Natural Sciences, Biochemistry, Chemistry +7

Spectroscopic, Hirshfeld surface, X-ray diffraction methodologies and local & global chemical activity calculations of 5-(2-methoxy-4-(prop-1-en-1-yl)phenoxy)pyrazine-2,3-dicarbonitrile

Zeynep Demi̇rci̇oğlu, Cem Cüneyt Ersanlı, Günay Kaya Kantar et al. · Journal of Molecular Structure · 2018 · 54 citations

Natural Sciences, Chemistry, Medicinal Chemistry +13