Recent developments on the potential biological applications of transition metal complexes of thiosemicarbazone derivatives
V Singh, VNV Palakkeezhillam, V Manakkadan… - Polyhedron, 2023 - Elsevier
This review talks about the synthesis, and coordination chemistry of thiosemicarbazone and
its bonding with transition metals like copper, nickel, zinc, palladium, and ruthenium and …
its bonding with transition metals like copper, nickel, zinc, palladium, and ruthenium and …
[HTML][HTML] A combined DFT, Monte Carlo, and MD simulations of adsorption study of heavy metals on the carbon graphite (111) surface
M Khnifira, W Boumya, J Attarki, A Mahsoune… - Chemical Physics …, 2022 - Elsevier
This work investigated the adsorption mechanism of heavy metals: silver (Ag), mercury (Hg),
cadmium (Cd), palladium (Pd), and zinc (Zn) on the carbon graphite (111) surface based on …
cadmium (Cd), palladium (Pd), and zinc (Zn) on the carbon graphite (111) surface based on …
Molecular dynamic simulations and computational DFT of adsorption performances of malachite green on the metal fluorides in aqueous medium
This work focused on the elucidation of the adsorption mechanism of malachite green (MG)
on different metal fluorides MF 2 surface (where M= Mg, Mn, Zn or Ni) using DFT and …
on different metal fluorides MF 2 surface (where M= Mg, Mn, Zn or Ni) using DFT and …
A comprehensive DFT study on organosilicon-derived fungicide flusilazole and its germanium analogue: A computational approach to Si/Ge bioisosterism
S Seri̇n - Journal of the Indian Chemical Society, 2023 - Elsevier
Bioisosterism, a specific molecular alteration processing, is an effective approach used in
agrochemical development studies as well as in pharmaceutical sciences. Analyzing some …
agrochemical development studies as well as in pharmaceutical sciences. Analyzing some …
Synthesis, characterisation and corrosion inhibitory study of Meldrum's acid Thiosemicarbazone: Weight Loss, SEM-EDX and DFT
NIF Idelfitri, NN Dzulkifli, NAN Ash'ari, S Sapari… - Inorganic Chemistry …, 2023 - Elsevier
Meldrum's acid thiosemicarbazone derivative, 2, 2-dimethyl-5-(4-nitrobenzylidene)-1, 3-
dioxane-4, 6-dione bis (4-ethyl-3-thiosemicarbazone)(4NMATSC), was successfully …
dioxane-4, 6-dione bis (4-ethyl-3-thiosemicarbazone)(4NMATSC), was successfully …
Copper (II) chelates derived from an N, N, O-tridentate 2-pyridinecarboxaldehyde-N4-phenylsemicarbazone: Synthesis, spectral aspects, crystal structure, FMO and …
M Sithambaresan, MRP Kurup, G Serdaroğlu… - Journal of Molecular …, 2023 - Elsevier
Seven novel Cu (II) complexes [Cu (HPySc) Cl 2](1),[Cu 2 (PySc) 2 (NO 3) 2]· H 2 O (2),[Cu
(HPySc)(SO 4)]· ½H 2 O (3),[Cu 2 (PySc) 2 (OAc) 2]· CH 3 OH (4),[Cu 2 (PySc) 2 Br 2]· H 2 O …
(HPySc)(SO 4)]· ½H 2 O (3),[Cu 2 (PySc) 2 (OAc) 2]· CH 3 OH (4),[Cu 2 (PySc) 2 Br 2]· H 2 O …
Metal complexes of new thiocarbohydrazones of Cu (I), Co (II), and Ni (II); identification by NMR, IR, mass, UV spectra, and DFT calculations
Substituted thiocarbohydrazones were synthesized to study their complexation capability
towards Cu (I), Co (II), and Ni (II) salts. The Cu (I) complexes showed ligation of one mole of …
towards Cu (I), Co (II), and Ni (II) salts. The Cu (I) complexes showed ligation of one mole of …
Synthesis of Zn (ii) coordination complexes, their molecular design and docking with SARS-CoV-2 RBD protein and Omicron spike protein
S Singh, M Choudhary - New Journal of Chemistry, 2024 - pubs.rsc.org
Two new Zn (II) coordination complexes, namely [Zn (L)(en)] ClO4 (1) and [Zn (L) 2](2), were
synthesized and designed as self-assembled vaccine candidates against the SARS-CoV-2 …
synthesized and designed as self-assembled vaccine candidates against the SARS-CoV-2 …
Novel Nickel (II) complex bearing acenaphthenequinone based thiosemicarbazone bis-Schiff Base: Synthesis, characterization, linkage isomers, antitumor activity …
M Ghassemzadeh, ME Moghadam, M Saeidifar… - Journal of Molecular …, 2024 - Elsevier
The synthesis of a new nickel (II) coordination complex bearing acenaphthenequinone bis
(thiosemicarbazone),[NiL], a N 2 S 2 tetradentate bis-Schiff base ligand (H 2 L), under reflux …
(thiosemicarbazone),[NiL], a N 2 S 2 tetradentate bis-Schiff base ligand (H 2 L), under reflux …
Novel metal (II) complexes with 2, 2'-bithiophene ligands as promising antibacterial agents: Spectral investigation, electrochemical behavior, DFT studies, in vitro and …
The present study reports the synthesis, characterization, electrochemical behavior, and
antimicrobial potential of novel bithiophene derivatives and their nickel (II) and copper (II) …
antimicrobial potential of novel bithiophene derivatives and their nickel (II) and copper (II) …