Works matching AU Beyramabadi, S. A.
Results: 51
Cu(II) Complex of a Schiff Base Derived from Pyridoxal: Synthesis, Experimental Characterization, DFT Studies, and Aim Analysis.
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- Journal of Structural Chemistry, 2019, v. 60, n. 8, p. 1256, doi. 10.1134/S0022476619080067
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Synthesis, Experimental and Theoretical Studies on N,N′-Dipyridoxyl(4-Chloro-1,2-Phenylenediamine) Tetradentate Ligand and Its Copper(II) Complex.
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- Journal of Structural Chemistry, 2019, v. 60, n. 8, p. 1243, doi. 10.1134/S0022476619080055
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Geometry, Tautomerism, and Noncovalent Interaction of Bentiromide with a Carbon-Nanotube and γ-Fe<sub>2</sub>O<sub>3</sub> Nanoparticles: A Quantum Mechanical Study.
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- Journal of Structural Chemistry, 2019, v. 60, n. 6, p. 1008, doi. 10.1134/S0022476619060155
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A Theoretical Investigation on the Regioselectivity of the Diels-Alder Cycloaddition of 9-(Methoxymethyl) Anthracene And Citraconic Anhydride.
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- Journal of Structural Chemistry, 2018, v. 59, n. 8, p. 1810, doi. 10.1134/S0022476618080085
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Tautomerism in the Sulfonamide Moiety: Synthesis, Experimental and Theoretical Characterizations.
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- Journal of Structural Chemistry, 2018, v. 59, n. 7, p. 1596, doi. 10.1134/S0022476618070119
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Spectroscopic (Ft-Ir, Nmr, Uv-Vis, Fluorescence) and Dft Studies (Molecular Structure, Ir and Nmr Spectral Assignments, Nbo and Fukui Function) of Schiff Bases Derived from 2-Chloro-3-Quinolinecarboxaldehyde.
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- Journal of Structural Chemistry, 2018, v. 59, n. 6, p. 1342, doi. 10.1134/S0022476618060136
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Experimental and Computational Investigations of 4-((E)-(2-Amino-5- Nitrophenylimino)Methyl)-5- (Hydroxymethyl)-2-Methylpyridin-3-Ol Schiff Base Derived from Vitamin B<sub>6</sub>.
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- Journal of Structural Chemistry, 2018, v. 59, n. 6, p. 1326, doi. 10.1134/S0022476618060112
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Tautomerization Reaction, Experimental and Theoretical Characterizations of the N,N′-Dipyridoxyl(4-Methyl-1,2-Phenylenediamine) Schiff Base and its Cu(II) Complex.
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- Journal of Structural Chemistry, 2018, v. 59, n. 5, p. 1102, doi. 10.1134/S0022476618050128
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Quantum mechanical study of carbon nanotubes functionalized with drug gentamicin.
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- Journal of Structural Chemistry, 2017, v. 58, n. 3, p. 462, doi. 10.1134/S0022476617030064
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Tautomerism of the antiepileptic drug Felbamate: A DFT study.
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- Journal of Structural Chemistry, 2017, v. 58, n. 2, p. 244, doi. 10.1134/S0022476617020044
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A DFT study on the geometry, spectroscopic properties, and tautomerization of the local anaesthetic drug prilocaine.
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- Journal of Structural Chemistry, 2016, v. 57, n. 6, p. 1096, doi. 10.1134/S0022476616060068
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Experimental and theoretical characterization of FeCr trinuclear-oxo-centered complex with a CFClCOO bridge.
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- Journal of Structural Chemistry, 2016, v. 57, n. 5, p. 875, doi. 10.1134/S002247661605005X
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Tautomerization of pyrido[2′,1′:2,3]imidazo[4,5-B]quinoline-12-ylcyanide: A DFT study.
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- Journal of Structural Chemistry, 2015, v. 56, n. 7, p. 1253, doi. 10.1134/S0022476615070045
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Intramolecular-proton transfer, experimental and theoretical characterization of 3,3′-dihydroxy-4,4′-[4,4′-diphenylmethanebis (nitrilomethylidyne)]-bis-phenol.
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- Journal of Structural Chemistry, 2015, v. 56, n. 5, p. 845, doi. 10.1134/S0022476615050054
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N,N′-dipyridoxyl(1,2-diaminocyclohexane) and its Cu(II) complex: Synthesis, experimental and theoretical studies.
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- Journal of Structural Chemistry, 2015, v. 56, n. 2, p. 243, doi. 10.1134/S0022476615020067
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Experimental and theoretical characterization of N,N′-bis(2,4-dihydroxybenzylidene)-1,2-diaminobenzene schiff base and its Cu(II) complex.
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- Journal of Structural Chemistry, 2013, v. 54, n. 6, p. 1055, doi. 10.1134/S0022476613060085
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3,3′-dihydroxy-4,4′-[1,2-cyclohexanediyl-bis(nitrilomethylidyne)]-bis-phenol schiff-base and its Mn(II) complex: Synthesis, experimental, and theoretical characterization.
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- Journal of Structural Chemistry, 2013, v. 54, n. 6, p. 1063, doi. 10.1134/S0022476613060097
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DFT characterization of 1-acetylpiperazinyl-dithiocarbamate ligand and its transition metal complexes.
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- Journal of Structural Chemistry, 2012, v. 53, n. 4, p. 665, doi. 10.1134/S0022476612040087
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N,N′-dipyridoxyl(ethylenediamine) schiff-base ligand and its square-pyramidal copper(II) complex: Synthesis, experimental and theoretical characterization.
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- Journal of Structural Chemistry, 2012, v. 53, n. 3, p. 460, doi. 10.1134/S0022476612030079
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A molecular dynamics study on the role of attractive and repulsive forces in excess heat capacity at constant volume of dense fluids.
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- Molecular Physics, 2012, v. 110, n. 8, p. 483, doi. 10.1080/00268976.2012.655795
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Anticancer Activities of Cu(II) Complex-Schiff Base and Low-Frequency Electromagnetic Fields and the Interaction Between Cu(II) Complex-Schiff Base with Bovine Serum Albumin by Spectroscopy.
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- Applied Biochemistry & Biotechnology, 2020, v. 190, n. 3, p. 997, doi. 10.1007/s12010-019-03118-7
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Density functional theoretical study on the mechanism of alcoholysis of acylpalladium(II) complexes.
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- Progress in Reaction Kinetics & Mechanism, 2017, v. 42, n. 1, p. 52, doi. 10.3184/146867816X14764496131511
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Theoretical investigation on the kinetics and mechanism of the synthesis of fluorescent 3,8-disubstituted-3H-imidazo[4,5-a]acridine-11-carbonitriles.
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- Progress in Reaction Kinetics & Mechanism, 2016, v. 41, n. 4, p. 365, doi. 10.3184/146867816X14720534560565
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Quantum mechanical investigation on the hydroxycarbonylation of styrene using a palladium complex catalyst.
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- Progress in Reaction Kinetics & Mechanism, 2016, v. 41, n. 3, p. 215, doi. 10.3184/146867816X14651385355863
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Mechanism of covalent adsorption of benzenesulfonamide onto COOH- and COCl- functionalised carbon nanotubes.
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- Progress in Reaction Kinetics & Mechanism, 2016, v. 41, n. 1, p. 100, doi. 10.3184/146867816X14490560291507
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Quantum mechanical study on the different fluxional mechanisms in a [Pd(η<sup>2</sup>-olefin) complex.
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- Progress in Reaction Kinetics & Mechanism, 2016, v. 41, n. 1, p. 91, doi. 10.3184/146867816X14514010028223
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Density functional theoretical study on the mechanism of adsorption of 2-chlorophenol from water using γ-Fe<sub>2</sub>O<sub>3</sub> nanoparticles.
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- Progress in Reaction Kinetics & Mechanism, 2015, v. 40, n. 2, p. 119, doi. 10.3184/146867815X14259937892267
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Experimental Sensing and Density Functional Theory Study of an Ionic Liquid Mediated Carbon Nanotube Modified Carbon-paste Electrode for Electrochemical Detection of Metronidazole.
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- South African Journal of Chemistry, 2017, v. 70, p. 29, doi. 10.17159/0379-4350/2017/v70a5
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COMPREHENSIVE QUANTUM MECHANICAL STUDY ON THE MECHANISTIC, ENERGETIC AND STRUCTURAL PROPERTIES OF ADSORPTION OF DRUG 6-THIOGUANINE ONTO FUNCTIONALIZED CARBON NANOTUBES.
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- Digest Journal of Nanomaterials & Biostructures (DJNB), 2017, v. 12, n. 3, p. 679
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Mn(II) complex of a vitamin B6 Schiff base as an exclusive apoptosis inducer in human MCF7 and HepG2 cancer cells: Synthesis, characterization, and biological studies.
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- Journal of Cellular Biochemistry, 2020, v. 121, n. 3, p. 2677, doi. 10.1002/jcb.29488
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Phosphomolybdic acid supported on Schiff base functionalized graphene oxide nanosheets: Preparation, characterization, and first catalytic application in the multi‐component synthesis of tetrahydrobenzo[a]xanthene‐11‐ones.
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- Applied Organometallic Chemistry, 2019, v. 33, n. 5, p. N.PAG, doi. 10.1002/aoc.4881
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Pyrido[1',2':1,5]pyrazolo[4,3-b]quinolines as New Fluorescent Heterocyclic Systems for Dye-Sensitized Solar Cells.
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- Russian Journal of General Chemistry, 2020, v. 90, n. 7, p. 1345, doi. 10.1134/S1070363220070233
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Efficient Synthesis of New Pyrimido[5′,4′:5,6]pyrano[2,3-d]pyrimidine-2,4,6(1H,3H)-triones via the Tandem Intramolecular Pinner–Dimroth Rearrangement, and Their Antibacterial Activity.
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- Russian Journal of General Chemistry, 2018, v. 88, n. 12, p. 2658, doi. 10.1134/S1070363218120290
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Synthesis of some new heterocycles containing quinazoline moiety.
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- Russian Journal of General Chemistry, 2017, v. 87, n. 10, p. 2429, doi. 10.1134/S1070363217100255
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Quantum Mechanical Study on the Mechanistic, Energetic, and Structural Properties of Adsorption of 6-Thioguanine onto γ- Fe<sub>2</sub>O<sub>3</sub> Nanoparticles.
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- Bulletin of the Korean Chemical Society, 2017, v. 38, n. 8, p. 869, doi. 10.1002/bkcs.11187
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Mechanistic, energetic and structural studies of carbon nanotubes functionalised with dihydroartemisinin drug in gas and solution phases.
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- Physics & Chemistry of Liquids, 2018, v. 56, n. 5, p. 610, doi. 10.1080/00319104.2017.1367790
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(E)-4-(((2-Amino-5-chlorophenyl)imino)methyl)-5-(hydroxymethyl)- 2-methylpyridin-3-ol and its Cu(II) complex: Synthesis, DFT calculations and AIM analysis.
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- Journal of the Serbian Chemical Society, 2020, v. 85, n. 8, p. 1033, doi. 10.2298/JSC191010022Y
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(E)-4-(((2-amino-5-chlorophenyl)imino)methyl)-5-(hydroxymethyl)- 2-methylpyridin-3-ol and its Cu(II) complex: Synthesis, DFT calculations and AIM analysis.
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- Journal of the Serbian Chemical Society, 2020, n. 0, p. 1, doi. 10.2298/JSC191010022Y
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Oxovanadium(IV) complexes of the pyridoxal Schiff bases: Synthesis, experimental and theoretical characterizations, QTAIM analysis and antioxidant activity.
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- Journal of the Serbian Chemical Society, 2020, v. 85, n. 1, p. 37, doi. 10.2298/JSC190129055G
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Oxovanadium(IV) complexes of the pyridoxal Schiff bases: Synthesis, experimental and theoretical characterizations, QTAIM analysis and antioxidant activity.
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- Journal of the Serbian Chemical Society, 2020, n. 0, p. 1, doi. 10.2298/JSC190129055G
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Isolation of intermediates in the synthesis of new 3,4-dihydro-2H-chromeno[2,3-d]pyrimidines.
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- Zeitschrift für Naturforschung B: A Journal of Chemical Sciences, 2018, v. 73, n. 8, p. 557, doi. 10.1515/znb-2018-0042
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Two new pyrrolo[2,3-d]pyrimidines (7-deazapurines): ultrasonic-assisted synthesis, experimental and theoretical characterizations as well as antibacterial evaluation.
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- Zeitschrift für Naturforschung B: A Journal of Chemical Sciences, 2017, v. 72, n. 7, p. 481, doi. 10.1515/znb-2017-0004
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Geometry, tautomerism and non-covalent interactions of the drug halofuginone with carbon-nanotubes and γ-Fe<sub>2</sub>O<sub>3</sub> nanoparticles: A DFT study.
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- Journal of the Serbian Chemical Society, 2018, v. 83, n. 3, p. 305, doi. 10.2298/jsc170608100k
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Mechanistic, energetic and structural studies of single-walled carbon nanotubes functionalized with penicillamine.
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- Journal of the Serbian Chemical Society, 2018, v. 83, n. 2, p. 167, doi. 10.2298/JSC170218072S
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Geometry, tautomerism and non-covalent interactions of the halofuginone drug with the carbon-nanotube and γ-Fe<sub>2</sub>O<sub>3</sub> nanoparticles: A DFT study.
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- Journal of the Serbian Chemical Society, 2018, v. 83, n. 1, p. 1, doi. 10.2298/JSC170608100K
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Mechanistic, energetic and structural studies of single-walled carbon nanotubes functionalized with penicillamine.
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- Journal of the Serbian Chemical Society, 2018, v. 83, n. 1, p. 1, doi. 10.2298/JSC170218072S
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Quantum Mechanical Study on the Mechanistic, Energetic and Structural Aspects of Adsorption of 2-methoxyestradiol Drug on Functionalized Carbon Nanotube.
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- Journal of the Chemical Society of Pakistan, 2018, v. 40, n. 3, p. 417
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Kinetics and mechanism of producing 3,8-dimethyl-3 H-imidazo[4,5- a]acridine-11-carbonitrile: a DFT investigation.
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- Research on Chemical Intermediates, 2017, v. 43, n. 3, p. 1829, doi. 10.1007/s11164-016-2733-2
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Kinetics and mechanism of the 1,3-dipolar cycloaddition of nitrilimine with thione-containing dipolarophile: a detailed DFT study.
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- Research on Chemical Intermediates, 2016, v. 42, n. 6, p. 6125, doi. 10.1007/s11164-016-2449-3
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Quantum mechanical study of the alkoxide-independent pathway of reductive elimination of C-O from palladium ( p-cyanophenyl) neopentoxide complex.
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- Research on Chemical Intermediates, 2015, v. 41, n. 8, p. 5389, doi. 10.1007/s11164-014-1640-7
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