Synthesis and spectroscopic characterization of schiff base metal complexes, biological activity, and molecular docking studies
New cobalt (II), copper (II), and zinc (II) Schiff metal complexes were synthesized by the
condensation reaction of 4-nitrobenzene-1, 2-diamine with 3–4-(diethylamino)-2 …
condensation reaction of 4-nitrobenzene-1, 2-diamine with 3–4-(diethylamino)-2 …
[HTML][HTML] Integrated experimental and computational study of a fluorescent Schiff base: Synthesis, characterization, electronic structure properties, and biological …
KJ Rajimon, DSR Nair, D Srinivasaragavan… - Chemical Physics …, 2024 - Elsevier
This work provides a thorough characterization of a Schiff base molecule that is produced
when terephthaldehyde and 2-chloroaniline are combined. A variety of spectroscopic …
when terephthaldehyde and 2-chloroaniline are combined. A variety of spectroscopic …
Unveiling the multifaceted potential of (E)-N-(4-Chlorophenyl)-1-(thiophen-2-yl) methanimine with special reference to solution-state fluorescence, synthesis …
Schiff bases exhibit distinctive characteristics in the realm of chemistry, physics, and
medicine, rendering them highly efficacious in the field of biology. A Schiff base was …
medicine, rendering them highly efficacious in the field of biology. A Schiff base was …
Solute solvent interaction study on 9, 9-dihydroxynanoic acid by DFT, IR, Raman, UV, MEP, quantum parameters and docking studies
Density functional quantum mechanical research yield a comprehensive theoretical
approach on the selected organic molecule of 9, 9-dihydroxynanoic acid. The DFT approach …
approach on the selected organic molecule of 9, 9-dihydroxynanoic acid. The DFT approach …
[HTML][HTML] Modeling of the structural, optoelectronic, thermodynamic, dynamical stability, and the hydrogen storage density of CsSnX3 (X= O, S, Se and Te) …
H Louis, EC Agwamba, UG Chukwu… - Chemistry of Inorganic …, 2023 - Elsevier
Based on density functional theory (DFT) approach, investigations on the structural,
thermodynamic, electronic, optoelectronic, phonon, mechanical, and the hydrogen …
thermodynamic, electronic, optoelectronic, phonon, mechanical, and the hydrogen …
Synthesis, computational, reactivity analysis, non-covalent interaction and docking studies on (N1E, N2E)-N1, N2-bis (2, 4-dichlorobenzylidene)-4-methylbenzene-1, 2 …
N Elangovan, TS Ganesan, A Vishveshwaran… - Journal of Molecular …, 2024 - Elsevier
Abstract Synthesis of (N 1 E, N 2 E)-N 1, N 2-bis (2, 4-dichlorobenzylidene)-4-
methylbenzene-1, 2-diamine (6B) using a procedure in a catalyst-free environment. The …
methylbenzene-1, 2-diamine (6B) using a procedure in a catalyst-free environment. The …
Synthesis, Solvatochromic Studies, DFT Calculations, Characterization, and In Silico Molecular Docking Studies of Azo Dyes of 3‐Methyl‐1‐phenyl‐1H‐pyrazol‐5 …
RB Shakuntala, J Keshavayya… - ChemistrySelect, 2024 - Wiley Online Library
In this work, the four azo dyes (A1–A4) were synthesized using 5‐amino‐3‐methyl‐1‐phenyl
pyrazole with four different coupling components by the conventional, simple diazo‐coupling …
pyrazole with four different coupling components by the conventional, simple diazo‐coupling …
[PDF][PDF] SPECTROSCOPIC, CRYSTAL STRUCTURE, HIRSHFELD SURFACE AND DFT STUDIES OF 2-AMINO-4-CHLOROBENZONITRILE
This research concentrates on a summary of the global reactivity parameters on the single
crystal structure of 2-amino-4-chlorobenzonitrile, which can be utilised in a wide range of …
crystal structure of 2-amino-4-chlorobenzonitrile, which can be utilised in a wide range of …