Density functional theory for transition metals and transition metal chemistry

CJ Cramer, DG Truhlar - Physical Chemistry Chemical Physics, 2009 - pubs.rsc.org
We introduce density functional theory and review recent progress in its application to
transition metal chemistry. Topics covered include local, meta, hybrid, hybrid meta, and …

Chiral and supramolecular model complexes for vanadium haloperoxidases: Host–guest systems and hydrogen bonding relays for vanadate species

W Plass - Coordination Chemistry Reviews, 2011 - Elsevier
Supramolecular interactions and hydrogen bonding play a fundamental role in determining
both structure and function of vanadate in enzymatic systems and in particular for the active …

Synthesis, spectral characterization and antimicrobial evaluation of Schiff base Cu (II), Ni (II) and Co (II) complexes

G Kumar, D Kumar, S Devi, R Johari… - European Journal of …, 2010 - Elsevier
M (II) complexes of the type [HLCu2Cl3],[HLCu2 (O (CO) CH3) 3],[HLM2Cl4 (H2O) 3] and
[HLM2 (OC (O) CH3) 4 (H2O) 3], where M= Ni (II), Co (II) have been synthesized by …

Synthesis and characterization of a highly selective turn-on fluorescent chemosensor for Sn2+ derived from diimine Schiff base

F Kolcu, D Erdener, İ Kaya - Synthetic Metals, 2021 - Elsevier
This study is exploratory in proposing a Schiff base (Ligand= L), which was designed and
synthesized through one-step condensation reaction using 2, 2′-bithiophene-5 …

Synthesis, characterization and biological activity of ferrocene-based Schiff base ligands and their metal (II) complexes

YT Liu, GD Lian, DW Yin, BJ Su - … Acta Part A: Molecular and Biomolecular …, 2013 - Elsevier
Metal (II) complexes derived from S-benzyl-N-(1-ferrocenyl-3-(4-methylbenzene)
acrylketone) dithiocarbazate; HL1, S-benzyl-N-(1-ferrocenyl-3-(4-chlorobenzene) …

New tricopper (ii) cores self-assembled from aminoalcohol biobuffers and homophthalic acid: synthesis, structural and topological features, magnetic properties and …

SSP Dias, MV Kirillova, V André, J Kłak… - Inorganic Chemistry …, 2015 - pubs.rsc.org
Two new crystalline materials [Cu3 (μ2-H3bis-tris) 2 (μ2-Hhpa) 2]· H2O (1) and [Cu3 (μ2-
H2tea) 2 (μ2-hpa)(μ3-hpa)] n (2) bearing distinct tricopper (II) cores were easily generated …

Co (II), Ni (II) and Cu (II) complexes with coumarin-8-yl Schiff-bases: spectroscopic, in vitro antimicrobial, DNA cleavage and fluorescence studies

SA Patil, SN Unki, AD Kulkarni, VH Naik… - Spectrochimica Acta Part …, 2011 - Elsevier
A new series of Co (II), Ni (II) and Cu (II) complexes of the type ML· 2H2O of Schiff-bases
derived from m-substituted thiosemicarbazides and 8-acetyl-7-hydroxy-4-methylcoumarin …

Aminoalcohols and benzoates-friends or foes? Tuning nuclearity of Cu (II) complexes, studies of their structures, magnetism, and catecholase-like activities as well as …

F Sama, AK Dhara, MN Akhtar, YC Chen… - Dalton …, 2017 - pubs.rsc.org
Herein, the coordination chemistry of a series of Cu (II) complexes of various aminoalcohol
and benzoate ligands was explored. The pH-dependent reactions of copper (II) salts with …

Phosphorus Schiff base ligand and its complexes: Experimental and theoretical investigations

VT Suleman, AAS Al‐Hamdani… - Applied …, 2020 - Wiley Online Library
A phosphorus‐containing Schiff base was prepared from bis {3‐[2‐(4‐amino‐1, 5‐dimethyl‐
2‐phenylpyrazol‐3‐ylideneamino) ethyl] indol‐1‐ylmethyl} phosphinic acid and …

Synthesis, crystal structures, quantum chemical studies and corrosion inhibition potentials of 4-(((4-ethylphenyl) imino) methyl) phenol and (E)-4-((naphthalen-2 …

EE Elemike, HU Nwankwo, DC Onwudiwe… - Journal of Molecular …, 2017 - Elsevier
Abstract Two Schiff base ligands, 4-(((4-ethylphenyl) imino) methyl) phenol (4EMP) and (E)-
4-((naphthalen-2-ylimino) methyl) phenol (4NMP) were synthesized by the reaction of 4 …