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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
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
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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

Demircioğlu, Zeynep ; Kaştaş, Çiğdem Albayrak ; Büyükgüngör, Orhan

Journal of molecular structure, 2015-07, Vol.1091, p.183-195 [Periódico revisado por pares]

Elsevier B.V

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

Demircioğlu, Zeynep ; Albayrak Kaştaş, Çiğdem ; Büyükgüngör, Orhan

Spectrochimica acta. Part A, Molecular and biomolecular spectroscopy, 2015-03, Vol.139, p.539-548 [Periódico revisado por pares]

Elsevier B.V

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3
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
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
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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

Demircioğlu, Zeynep ; Kaştaş, Gökhan ; Kaştaş, Çiğdem Albayrak ; Frank, René

Journal of molecular structure, 2019-09, Vol.1191, p.129-137 [Periódico revisado por pares]

Elsevier B.V

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4
Scrutinizing the two new o-hydroxy Schiff bases from the point of tautomeric behavior and non-covalent interactions (H-bond, Br⋯Br, π⋯π and CH⋯π) in their supramolecular architectures
Scrutinizing the two new o-hydroxy Schiff bases from the point of tautomeric behavior and non-covalent interactions (H-bond, Br⋯Br, π⋯π and CH⋯π) in their supramolecular architectures
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Scrutinizing the two new o-hydroxy Schiff bases from the point of tautomeric behavior and non-covalent interactions (H-bond, Br⋯Br, π⋯π and CH⋯π) in their supramolecular architectures

Kaştaş, Gökhan ; Kaştaş, Çiğdem Albayrak

Journal of molecular structure, 2019-05, Vol.1184, p.427-434 [Periódico revisado por pares]

Elsevier B.V

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5
Synthesis, crystal structure, computational chemistry studies and Hirshfeld surface analysis of two Schiff bases, (E)-2-[(4-bromo-2-methylphenylimino)methyl]-4-methylphenol and (E)-2-[(4-bromo-2-methylphenylimino)methyl]-6-methylphenol
Synthesis, crystal structure, computational chemistry studies and Hirshfeld surface analysis of two Schiff bases, (E)-2-[(4-bromo-2-methylphenylimino)methyl]-4-methylphenol and (E)-2-[(4-bromo-2-methylphenylimino)methyl]-6-methylphenol
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Synthesis, crystal structure, computational chemistry studies and Hirshfeld surface analysis of two Schiff bases, (E)-2-[(4-bromo-2-methylphenylimino)methyl]-4-methylphenol and (E)-2-[(4-bromo-2-methylphenylimino)methyl]-6-methylphenol

Demircioğlu, Zeynep ; Kaştaş, Çiğdem Albayrak ; Kaştaş, Gökhan ; Ersanlı, Cem Cüneyt

Molecular Crystals and Liquid Crystals, 2021-07, Vol.723 (1), p.45-61 [Periódico revisado por pares]

Philadelphia: Taylor & Francis

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6
Synthesis, Spectroscopic, Conceptual DFT Characterization and Molecular Docking Studies of Two Versatile di-Bromobenzaldehyde Derived Compounds
Synthesis, Spectroscopic, Conceptual DFT Characterization and Molecular Docking Studies of Two Versatile di-Bromobenzaldehyde Derived Compounds
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Synthesis, Spectroscopic, Conceptual DFT Characterization and Molecular Docking Studies of Two Versatile di-Bromobenzaldehyde Derived Compounds

Yıldırım, Arzu Özek ; Yıldırım, Muhammet Hakkı ; Kaştaş, Çiğdem Albayrak

Polycyclic aromatic compounds, 2022-09, Vol.42 (8), p.5599-5615 [Periódico revisado por pares]

Philadelphia: Taylor & Francis

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7
Molecular and electronic structures of two new Schiff base compounds: (E)-2-bromo-6-[(2-bromo-4-methylphenylimino) methyl]-4-chlorophenol and (E)-2-bromo-6-[(4-bromo-3-methylphenylimino) methyl]-4-chlorophenol
Molecular and electronic structures of two new Schiff base compounds: (E)-2-bromo-6-[(2-bromo-4-methylphenylimino) methyl]-4-chlorophenol and (E)-2-bromo-6-[(4-bromo-3-methylphenylimino) methyl]-4-chlorophenol
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Molecular and electronic structures of two new Schiff base compounds: (E)-2-bromo-6-[(2-bromo-4-methylphenylimino) methyl]-4-chlorophenol and (E)-2-bromo-6-[(4-bromo-3-methylphenylimino) methyl]-4-chlorophenol

Kırca, Başak Koşar ; Kaştaş, Çiğdem Albayrak ; Ersanlı, Cem Cüneyt

Journal of molecular structure, 2021-10, Vol.1241, p.130643, Article 130643 [Periódico revisado por pares]

Elsevier B.V

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8
Dependence of tautomerism on substituent type in o-hydroxy Schiff bases
Dependence of tautomerism on substituent type in o-hydroxy Schiff bases
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Dependence of tautomerism on substituent type in o-hydroxy Schiff bases

Kastas, Cigdem Albayrak ; Kastas, Gokhan

Macedonian Journal of Chemistry and Chemical Engineering, 2019-01, Vol.38 (1), p.85-94

Society of Chemists and Technologists of Macedonia

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9
Studies on the synthesis, spectroscopic analysis and DFT calculations on (E)-4,6-dichloro-2-[(2-chlorophenylimino)methyl]-3methoxyphenol as a novel Schiff's base
Studies on the synthesis, spectroscopic analysis and DFT calculations on (E)-4,6-dichloro-2-[(2-chlorophenylimino)methyl]-3methoxyphenol as a novel Schiff's base
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Studies on the synthesis, spectroscopic analysis and DFT calculations on (E)-4,6-dichloro-2-[(2-chlorophenylimino)methyl]-3methoxyphenol as a novel Schiff's base

Yildirima, Arzu Oezek ; Yildirimb, MHakki ; Kastasc, Cigdem Albayrak

Journal of molecular structure, 2016-06, Vol.1113, p.1-8 [Periódico revisado por pares]

Elsevier B.V

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10
The effect of the change in substituents’ positions on the formation of supramolecular networks and the solvent type/substituent dependence of prototropic behavior in three new o-hydroxy Schiff bases
The effect of the change in substituents’ positions on the formation of supramolecular networks and the solvent type/substituent dependence of prototropic behavior in three new o-hydroxy Schiff bases
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The effect of the change in substituents’ positions on the formation of supramolecular networks and the solvent type/substituent dependence of prototropic behavior in three new o-hydroxy Schiff bases

Kaştaş, Gökhan ; Kaştaş, Çiğdem Albayrak ; Kırca, Başak Koşar ; Ersanlı, Cem Cüneyt

Journal of molecular structure, 2020-01, Vol.1200, p.127109, Article 127109 [Periódico revisado por pares]

Elsevier B.V

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