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61 ta ish

Ish: Electronic Structure, Absorption, and Cyclic Voltammetry Studies of Bis-Imine Schiff Base: a Combined Experimental and Theoretical Correlation

  1. Synthesis, structural investigation, computational study, antimicrobial activity and molecular docking studies of novel synthesized (E)-4-((pyridine-4-ylmethylene)amino)-N-(pyrimidin-2-yl)benzenesulfonamide from pyridine-4-carboxaldehyde and sulfadiazine

    N. Elangovan, S. Sowrirajan, K. Manoj +1

    Maqola20212 iqtibos
    ABI

  2. Synthesis, antimicrobial evaluation, crystal structure, Hirschfeld surface analysis and docking studies of 4-[2-(1-methyl-1H-imidazol-2-ylsulfanyl)-acetylamino]-benzenesulfonic acid

    Mohammed H. Geesi, Yassine Riadi, Abdellah Kaïba +5

    Maqola20222 iqtibos
    ABI

  3. Novel α-aminophosphonate derivates synthesis, theoretical calculation, Molecular docking, and in silico prediction of potential inhibition of SARS-CoV-2

    Rachida Kerkour, Nadjib Chafai, Ouahiba Moumeni +1

    Maqola20222 iqtibos
    ABI

  4. Schiff bases from chlorine substituted anilines and salicylaldehyde: Synthesis, characterization, fluorescence, thermal features, biological studies and electronic structure investigations

    K.J. Rajimon, N. Elangovan, Ali A. Khairbek +1

    Maqola20222 iqtibos
    ABI

  5. Design, synthesis, characterizing and DFT calculations of a binary CT complex co-crystal of bioactive moieties in different polar solvents to investigate its pharmacological activity

    Maidul Islam, Ishaat M. Khan, Sonam Shakya +1

    Maqola20222 iqtibos
    ABI

  6. Synthesis and spectrophotometric studies of charge transfer complexes of benzamide with picric acid in different polar solvents

    Neeti Singh, Ishaat M. Khan, Afaq Ahmad

    Maqola20132 iqtibos
    ABI

  7. Microwave-assisted synthesis, third-order nonlinear optical properties, voltammetry cyclic and theoretical calculations of organotin compounds bearing push–pull Schiff bases

    María C. García-López, Blanca M. Muñoz‐Flores, Rodrigo Chan‐Navarro +5

    Maqola20162 iqtibos
    ABI

  8. Synthesis, spectra (FT-IR, NMR) investigations, DFT, FMO, MEP, NBO analysis and catalytic activity of MoO2(VI) complex with ONO tridentate hydrazone Schiff base ligand

    Hadi Kargar, Mehdi Fallah‐Mehrjardi, Reza Behjatmanesh‐Ardakani +1

    Maqola20212 iqtibos
    ABI

  9. Synthesis, characterization, antimicrobial activity and computational exploration of ortho toludinium carboxylate ionic liquids

    Ajoy Kumer, Md Wahab Khan

    Maqola20212 iqtibos
    ABI

  10. Synthesis, spectroscopic characterization, antimicrobial activity, molecular docking and DFT studies of proton transfer (H-bonded) complex of 8-aminoquinoline (donor) with chloranilic acid (acceptor)

    Ishaat M. Khan, Maidul Islam, Sonam Shakya +3

    Maqola20212 iqtibos
    ABI

  11. Green synthesis of chromonyl chalcone and pyrazoline as potential antimicrobial agents – DFT, molecular docking and antimicrobial studies

    Mohammed Musthafa T.N., Kirti Snigdha, Abdullah M. Asiri +2

    Maqola20222 iqtibos
    ABI

  12. Synthesis, X-ray structural, characterization, NBO and HOMO–LUMO analysis using DFT study of 4-methyl-N-(naphthalene-1-yl)benzene sulfonamide

    K. Sarojini, H. Krishnan, Charles C. Kanakam +1

    Maqola20122 iqtibos
    ABI

  13. 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, Çiğdem Albayrak Kaştaş, Orhan Büyükgüngör

    Maqola20142 iqtibos
    ABI

  14. Synthesis, molecular structure, spectroscopic characterization, NBO, NLO and NPA analysis and in vitro cytotoxicity study of 3-chloro-N-(4-sulfamoylphenethyl)propanamide with experimental and computational study

    Mustafa Durgun, Ümit Ceylan, Şerife Pınar Yalçın +3

    Maqola20162 iqtibos
    ABI

  15. Spectroscopic (FTIR, FT-Raman, 1H NMR and UV–Vis) and DFT/TD-DFT studies on cholesteno [4,6-b,c]-2′,5′-dihydro-1′,5′-benzothiazepine

    Mohammad Jane Alam, Azhar U. Khan, Mahboob Alam +1

    Maqola20182 iqtibos
    ABI

  16. Synthesis of <i>Bis</i>-Schiff Base: Structural, Spectral, DFT, Electronic Properties, NCI, Topology, and Molecular Docking Studies

    N. Elangovan, R Yogeswaran, T. Sankar Ganesan +4

    Maqola20252 iqtibos
    ABI

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