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Crystal Structure, Spectroscopy, and Quantum Chemical Studies of (E)-2-[(2-Chlorophenyl)iminomethyl]-4-trifluoromethoxyphenol

The journal of physical chemistry. A, Molecules, spectroscopy, kinetics, environment, & general theory, 2011-12, Vol.115 (47), p.13865-13876

Tanak, Hasan

2011

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Crystal Structure, Spectroscopic and DFT Computational Studies of N-(4-Fluorophenyl)-1-(5-Nitrothiophen-2-yl)methanimine

Crystallography reports, 2020-12, Vol.65 (7), p.1221-1225

2020

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Synthesis, Molecular Structure and Spectroscopic Studies of 6,6'-(1E,1'E)-(Ethane-1,2-Diylbis(azan-1-yl-1-ylidene))bis(Phenylmethan-1-yl-1-ylidene)bis(3-(Octyloxy)phenol)

Crystallography reports, 2020-12, Vol.65 (7), p.1217-1220

2020

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Molecular structure, spectroscopic (FT-IR and UV-Vis) and DFT quantum-chemical studies on 2-[(2,4-Dimethylphenyl)iminomethyl]-6-methylphenol

Molecular physics, 2014-06, Vol.112 (11), p.1553-1565

Tanak, Hasan

2014

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Experimental and Computational Approaches to the Molecular Structure of 3-(2-Mercaptopyridine)phthalonitrile

Bulletin of the Korean Chemical Society, 2011, 32(2), , pp.673-680

2011

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Density functional computational studies on 2-[(2,4-Dimethylphenyl)iminomethyl]-3,5-dimethoxyphenol

International journal of quantum chemistry, 2012-06, Vol.112 (11), p.2392-2402

Tanak, Hasan

2012

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DFT Quantum Chemical Studies on Structural, Nonlinear Optical, Reactivity and Thermodynamic Properties of 4‐Methoxy‐2‐{(E)‐[(thiophen‐2‐yl)ethylimino]methyl}phenol

ChemistrySelect (Weinheim), 2019-09, Vol.4 (36), p.10876-10883

Tanak, Hasan

2019

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Crystal structure and DFT computational studies of ( E )-2,4-di- tert -butyl-6-{[3-(tri-fluoro-meth-yl)benz-yl]imino-meth-yl}phenol

Acta crystallographica. Section E, Crystallographic communications, 2020-05, Vol.76 (Pt 5), p.732-735

2020

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Density functional computational studies on (E)-2-[(2-Hydroxy-5-nitrophenyl)-iminiomethyl]-4-nitrophenolate

Journal of molecular modeling, 2010-02, Vol.16 (2), p.235-241

2010

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DFT computational modeling studies on 4-(2,3-Dihydroxybenzylideneamino)-3-methyl-1H-1,2,4-triazol-5(4H)-one

Computational and theoretical chemistry, 2011-07, Vol.967 (1), p.93-101

Tanak, Hasan

2011

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Congo red filtration by polyacrylonitrile-based copolymer membranes

Canadian journal of chemistry, 2020-08, Vol.98 (8), p.421-426

2020

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Molecular structure, spectroscopic and quantum chemical studies on 2′-chloro-4-dimethlamino azobenzene

Journal of molecular structure, 2014-06, Vol.1068, p.189-197

2014

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Molecular structure and vibrational and chemical shift assignments of 3′-chloro-4-dimethylamino azobenzene by DFT calculations

Spectrochimica acta. Part A, Molecular and biomolecular spectroscopy, 2016-01, Vol.152, p.530-536

2016

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DFT quantum chemical studies of (E)-4-Bromo-N-(2-chlorobenzylidene)-aniline

Applied physics. A, Materials science & processing, 2017, Vol.123 (1), p.1-6, Article 91

2017

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Molecular structure and vibrational assignment of 1-[N-(2-pyridyl) aminomethylidene}-2(1H)-Naphtalenone by density functional theory (DFT) and ab initio Hartree–Fock (HF) calculations

Spectrochimica acta. Part A, Molecular and biomolecular spectroscopy, 2016-01, Vol.152, p.525-529

2016

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Quantum chemical studies on the molecular structure, spectroscopic and electronic properties of (6-Methoxy-2-oxo-2H-chromen-4-yl)-methyl pyrrolidine-1-carbodithioate

Materials science--Poland, 2016-12, Vol.34 (4), p.886-904

2016

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Molecular structure, vibrational spectra, NLO and MEP analysis of bis[2-hydroxy-кO-N-(2-pyridyl)-1-naphthaldiminato-кN]zinc(II)

Spectrochimica acta. Part A, Molecular and biomolecular spectroscopy, 2013-11, Vol.115, p.145-153

2013

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2-{( E )-[(2-Methyl-3-nitrophenyl)imino]methyl}-4-nitrophenol

Acta crystallographica. Section E, Structure reports online, 2013-07, Vol.69 (7), p.o1085-o1085

2013

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Structural, spectroscopic and electronic properties of 4-bromo-5-fluoro-2-((3-nitrophenylimino)methyl)phenol Schiff-base molecule: Experimental and theoretical investigations

Journal of molecular structure, 2019-12, Vol.1197, p.9-18

2019

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Experimental and DFT computational studies of novel 3-(p-cyanophenyl)-5-(o,m,p-nitrophenyl)-5-phenylformazans

Journal of molecular structure, 2020-08, Vol.1213, p.128178, Article 128178

2020

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Experimental (XRD, FT-IR and UV–Vis) and theoretical modeling studies of Schiff base (E)-N′-((5-nitrothiophen-2-yl)methylene)-2-phenoxyaniline

Spectrochimica acta. Part A, Molecular and biomolecular spectroscopy, 2014-01, Vol.118, p.672-682

2014

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Experimental (XRD, IR and NMR) and theoretical investigations on 1-(2-nitrobenzoyl)3,5-bis(4-methoxyphenyl)-4,5-dihydro-1H-pyrazole

Journal of molecular structure, 2016-12, Vol.1126, p.117-126

2016

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Crystal structure of 2-{[(5-nitro-thio-phen-2-yl)methyl-idene]amino}-phenol

Acta crystallographica. Section E, Crystallographic communications, 2015-06, Vol.71 (Pt 6), p.o418-o418

2015

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Crystal structure, spectroscopic investigations and density functional studies of 4-(4-methoxyphenethyl)-5-benzyl-2H-1,2,4-triazol-3(4H)-one monohydrate

Spectrochimica acta. Part A, Molecular and biomolecular spectroscopy, 2012-07, Vol.93, p.106-115

2012

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Investigation of antimicrobial activities, DNA interaction, structural and spectroscopic properties of 2-chloro-6-(trifluoromethyl)pyridine

Journal of molecular structure, 2017-06, Vol.1137, p.206-215

2017

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Crystal Structure, Spectroscopy, and Quantum Chemical Studies of (E)-2-[(2-Chlorophenyl)iminomethyl]-4-trifluoromethoxyphenol

Crystal Structure, Spectroscopic and DFT Computational Studies of N-(4-Fluorophenyl)-1-(5-Nitrothiophen-2-yl)methanimine

Synthesis, Molecular Structure and Spectroscopic Studies of 6,6'-(1E,1'E)-(Ethane-1,2-Diylbis(azan-1-yl-1-ylidene))bis(Phenylmethan-1-yl-1-ylidene)bis(3-(Octyloxy)phenol)

Molecular structure, spectroscopic (FT-IR and UV-Vis) and DFT quantum-chemical studies on 2-[(2,4-Dimethylphenyl)iminomethyl]-6-methylphenol

Experimental and Computational Approaches to the Molecular Structure of 3-(2-Mercaptopyridine)phthalonitrile

Density functional computational studies on 2-[(2,4-Dimethylphenyl)iminomethyl]-3,5-dimethoxyphenol

DFT Quantum Chemical Studies on Structural, Nonlinear Optical, Reactivity and Thermodynamic Properties of 4‐Methoxy‐2‐{(E)‐[(thiophen‐2‐yl)ethylimino]methyl}phenol

Crystal structure and DFT computational studies of ( E )-2,4-di- tert -butyl-6-{[3-(tri-fluoro-meth-yl)benz-yl]imino-meth-yl}phenol

Density functional computational studies on (E)-2-[(2-Hydroxy-5-nitrophenyl)-iminiomethyl]-4-nitrophenolate

DFT computational modeling studies on 4-(2,3-Dihydroxybenzylideneamino)-3-methyl-1H-1,2,4-triazol-5(4H)-one

Congo red filtration by polyacrylonitrile-based copolymer membranes

Molecular structure, spectroscopic and quantum chemical studies on 2′-chloro-4-dimethlamino azobenzene

Molecular structure and vibrational and chemical shift assignments of 3′-chloro-4-dimethylamino azobenzene by DFT calculations

DFT quantum chemical studies of (E)-4-Bromo-N-(2-chlorobenzylidene)-aniline

Molecular structure and vibrational assignment of 1-[N-(2-pyridyl) aminomethylidene}-2(1H)-Naphtalenone by density functional theory (DFT) and ab initio Hartree–Fock (HF) calculations

Quantum chemical studies on the molecular structure, spectroscopic and electronic properties of (6-Methoxy-2-oxo-2H-chromen-4-yl)-methyl pyrrolidine-1-carbodithioate

Molecular structure, vibrational spectra, NLO and MEP analysis of bis[2-hydroxy-кO-N-(2-pyridyl)-1-naphthaldiminato-кN]zinc(II)

2-{( E )-[(2-Methyl-3-nitrophenyl)imino]methyl}-4-nitrophenol

Structural, spectroscopic and electronic properties of 4-bromo-5-fluoro-2-((3-nitrophenylimino)methyl)phenol Schiff-base molecule: Experimental and theoretical investigations

Experimental and DFT computational studies of novel 3-(p-cyanophenyl)-5-(o,m,p-nitrophenyl)-5-phenylformazans

Experimental (XRD, FT-IR and UV–Vis) and theoretical modeling studies of Schiff base (E)-N′-((5-nitrothiophen-2-yl)methylene)-2-phenoxyaniline

Experimental (XRD, IR and NMR) and theoretical investigations on 1-(2-nitrobenzoyl)3,5-bis(4-methoxyphenyl)-4,5-dihydro-1H-pyrazole

Crystal structure of 2-{[(5-nitro-thio-phen-2-yl)methyl-idene]amino}-phenol

Crystal structure, spectroscopic investigations and density functional studies of 4-(4-methoxyphenethyl)-5-benzyl-2H-1,2,4-triazol-3(4H)-one monohydrate

Investigation of antimicrobial activities, DNA interaction, structural and spectroscopic properties of 2-chloro-6-(trifluoromethyl)pyridine

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