Search results for "ligand"

showing 10 items of 2559 documents

Crystal structure and magnetic properties of Cu(TIM)CuBr4: An alternating site-alternating exchange chain system

2007

Abstract The title compound, Cu(TIM)CuBr4 (where TIM is a macrocycle ligand) is a member of the Cu(TIM)MX4 family, which contains linear chain structures with ⋯ Cu ⋯ X – M – X ⋯ Cu ⋯ X – M - ⋯ linkages. This chain structure defines an alternating exchange/alternating site 1d system. For M=Cu, alternating FM/AFM chains are formed with JFM>| JAFM|. Structural and magnetic data are presented, along with an analysis of the exchange pathways.

Chain structureCrystallographyNuclear magnetic resonanceMaterials scienceChain (algebraic topology)Atomic force microscopyLigandChain systemCrystal structureCondensed Matter PhysicsElectronic Optical and Magnetic MaterialsJournal of Magnetism and Magnetic Materials
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Synthesis, biological evaluation, and: In silico studies of novel chalcone: In pyrazoline-based 1,3,5-triazines as potential anticancer agents

2020

A novel series of triazin-chalcones (7,8)a-g and triazin-N-(3,5-dichlorophenyl)pyrazolines (9,10)a-g were synthesized and evaluated for their anticancer activity against nine different cancer strains. Triazine ketones 5 and 6 were synthesized from the cyanuric chloride 1 by using stepwise nucleophilic substitution of the chlorine atom. These ketones were subsequently subjected to a Claisen-Schmidt condensation reaction with aromatic aldehydes affording chalcones (7,8)a-g. Then, N-(3,5-dichlorophenyl)pyrazolines (9,10)a-g were obtained by cyclocondensation reactions of the respective chalcones (7,8)a-g with 3,5-dichlorophenylhydrazine. Among all the evaluated compounds, chalcones 7d,g and 8g…

ChalconeGeneral Chemical EngineeringCyanuric chloridePyrazolineTriazine derivatives01 natural sciencesClaisen Schmidt condensation03 medical and health scienceschemistry.chemical_compoundNucleophilic substitutionNucleophilic substitution030304 developmental biologyTriazinechemistry.chemical_classification0303 health sciences010405 organic chemistryLigandBiological evaluationGeneral ChemistryCondensation reactionCombinatorial chemistryCyclocondensation reaction0104 chemical sciencesEnzymechemistryAnticancer activitieThymidylate synthasePotential anticancer agent
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Photochemical ligand rearrangement in dirhodium(II) compounds. Structure of Rh2(O2CCH3)2(η2-O2CCH3)[(C6H4)PPh2] (η2-PCCl)(PCClP-ClC6H4)Ph2

1995

Abstract The photochemical reaction of the adducts Rh2(O2CCH3)3[(C6H4)P(o-ClC6H4)Ph]· (P(p-XC6H4)3) (X=H, Me, Cl), yield the compounds Rh2(O2CCH3)2(η2-O2CCH3)[(p-XC6H3)P (p-XC6H4)2](η2-PCCl), (PCCl=P(o-ClC6H4)Ph2) in a ligand rearrangement reaction that involves activation of CH and RhC bonds. The factors that favour this process are studied by carrying out photochemical reactions with different phosphines. The structures of Rh2(O2CCH3)2(η2-O2CCH3) [(C6H4)PPh2](η2-PCCl) has been determined by X-ray diffraction. Mr=1321.1, orthorhombic, space group Pbcn, a=20.339(8), b=20.07(6), c=23.07(3) A , V=9413(3) A 3 , Z=8, D x =1.86 g cm −3 . Mo Kα radiation (graphite crystal monochromator, λ=0.071…

Chelating ligandsChemistryLigandCrystal structurePhotochemistryAdductInorganic ChemistryBond lengthchemistry.chemical_compoundMaterials ChemistryRearrangement reactionOrthorhombic crystal systemPhysical and Theoretical ChemistryTriphenylphosphineInorganica Chimica Acta
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Malonato complexes of oxidovanadium(IV): Synthesis, structural characterization and exploration of their insulin mimetic properties

2011

Abstract Several bis-malonatooxidovanadium(IV) complexes of the general type [M2(H2O)n][VO(mal)2(H2O)] (where M = Li(1), Na(2), K(3), Cs(4) and NH4(5); n = 3.5, 1, 3, 1 and 1, respectively) were isolated in good yield and high purity. These complexes were fully characterized by various physicochemical techniques (elemental analysis, UV–Vis, IR, EPR, CV, etc.) complexes 1, 2 and 3 were structurally characterized by single crystal X-ray diffraction technique. In vivo antidiabetic properties of bis-malonato complexes 1, 2, 3 and 5 have been studied using Streptozotocin induced diabetic rats. Significant lowering of blood sugar level has been noticed. At the same time these complexes were found…

Chelating ligandsStereochemistryChemistryStreptozotocinMedicinal chemistrylaw.inventionInorganic ChemistryIn vivolawYield (chemistry)X-ray crystallographyMaterials ChemistrymedicinePhysical and Theoretical ChemistryInsulin mimeticElectron paramagnetic resonanceSingle crystalmedicine.drugInorganica Chimica Acta
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Dinuclear Palladium(II) and -(III) Compounds with O,O-Chelating Ligands. Room-Temperature Direct 2-Phenylation of 1-Methylindole

2012

New dinuclear palladium(III) compounds of general formula Pd2[(C6H4)PPh2]2[O–O]2Cl2, O–O being chelating phenolates C6H4OC(O)R (R = CH3, 3a; R = C2H5, 3b; R = OPh, 3c) or acetylacetonates RC(O)CHC(O)R (R = CH3, 4a; R = CF3, 4b; R = C(CH3)3, 4c), have been obtained by oxidation with PhICl2 of the corresponding palladium(II) compounds. The stability of the new compounds has been studied by 31P NMR spectroscopy from 200 to 298 K. DFT calculations of the stability of the complexes have also been performed. In agreement with these calculations, only compound Pd2[(C6H4)PPh2]2[(CF3C(O)CHC(O)CF3]2Cl2, 6b, showed the highest thermal stability. 6b was characterized by X-ray diffraction methods, prese…

Chelating ligandsStereochemistryOrganic Chemistrychemistry.chemical_elementMedicinal chemistryCatalysisInorganic Chemistrychemistry.chemical_compoundchemistryThermal stabilityChelation1-Methylindole31p nmr spectroscopyPhysical and Theoretical ChemistryPalladiumOrganometallics
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Synthesis and X-ray crystal structure of manganese(II) pyridine-2-thiolate

1997

2:1 complexes of pyridine-2(1H)-thione (LH) with manganese(II) were prepared: (LH)2MnCl2, (LH)2MnBr2 and [L2Mn]n. The polymeric chain structure of [L2Mn]n contains a distorted octahedrally coordinated manganese (MnN2S4) with chelating ligands, the N-atoms are in cis positions and the S-atoms of the pyridine-2-thiolates bridging; crystallographic data for [C10H8MnN2S2]n: space group C2/c (monoclinic), and R1 = 0.0571 for 1326 reflexes with Fo4σ(Fo).

Chelating ligandsX-raychemistry.chemical_elementCrystallographic dataCrystal structureManganeseInorganic ChemistryChain structureCrystallographychemistryPyridine-2-thiolateMaterials ChemistryPhysical and Theoretical ChemistryMonoclinic crystal systemInorganica Chimica Acta
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Speciation of chitosan with low and high molecular weight carboxylates in aqueous solution

2009

Quantitative data on the speciation of chitosan (310 kDa) with low and high molecular weight carboxylates in aqueous solution are reported. The following carboxylic ligands were considered: monocarboxylate (butyrate); dicarboxylates (malonate, succinate, azelate); tricarboxylate (1,2,3-propa- netricarboxylate); tetracarboxylate (1,2,3,4-butanetetracarboxylate); polyacrylates (2.0 and 20 kDa); polymethacrylate (5.4 kDa). The investigation was performed by potentiometry at t 1/4 25 C, at low ionic strength (without addition of supporting electrolyte) and at I 1/4 0:15 mol L 1 (NaCl). For all the systems the formation of (chitosan)LHi species was found (L 1/4 carboxylic ligand; i 1/4 1 to 4 de…

Chemical Health and SafetyAqueous solutionpolyammonium-polycarboxylate interactionsSupporting electrolyteLigandHealth Toxicology and MutagenesisInorganic chemistrychitosan; polyammonium-polycarboxylate interactions; Chemical speciation; sequestration; effect of ionic strength on sequestrationsequestrationToxicologyTricarboxylateMedicinal chemistrychitosan polyammonium polycarboxylate speciation sequestration ionic strenght.Chitosanchemistry.chemical_compoundMalonatechemistryIonic strengthChemical speciationSettore CHIM/01 - Chimica Analiticaeffect of ionic strength on sequestrationCarboxylatechitosanChemical Speciation & Bioavailability
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A Rational Design for Imidazolate-Bridged Linear Trinuclear Compounds from Mononuclear Copper(II) Complexes with 2-[((Imidazol-2-ylmethylidene)amino)…

2001

Two mononuclear copper(II) complexes with the unsymmetrical tridentate ligand 2-[((imidazol-2-ylmethylidene)amino)ethyl]pyridine (HL), [Cu(HL)(H2O)](ClO4)2.2H2O (1) and [Cu(HL)Cl2] (2), have been prepared and characterized. The X-ray analysis of 2 revealed that the copper(II) ion assumes a pentacoordinated square pyramidal geometry with an N3Cl2 donor set. When 1 and 2 are treated with an equimolecular amount of potassium hydroxide, the deprotonation of the imidazole moiety promotes a self-assembled process, by coordination of the imidazolate nitrogen atom to a Cu(II) center of an adjacent unit, leading to the polynuclear complexes [[Cu(L)(H2O)](ClO4)]n (3) and [[Cu(L)Cl].2H2O]n (4). Variab…

Chemical PhenomenaPyridinesStereochemistryMolecular Conformationchemistry.chemical_elementCrystallography X-RayLigandsInorganic ChemistryMagneticschemistry.chemical_compoundDeprotonationImidazolatePyridineOrganometallic CompoundsImidazolePhysical and Theoretical ChemistryIsostructuralChemistry PhysicalChemistryLigandImidazolesHydrogen BondingCopperSquare pyramidal molecular geometryCrystallographyCopperInorganic Chemistry
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Atomically Precise Alkynyl-Protected Metal Nanoclusters as a Model Catalyst: Observation of Promoting Effect of Surface Ligands on Catalysis by Metal…

2016

Metal nanoclusters whose surface ligands are removable while keeping their metal framework structures intact are an ideal system for investigating the influence of surface ligands on catalysis of metal nanoparticles. We report in this work an intermetallic nanocluster containing 62 metal atoms, Au34Ag28(PhC≡C)34, and its use as a model catalyst to explore the importance of surface ligands in promoting catalysis. As revealed by single-crystal diffraction, the 62 metal atoms in the cluster are arranged as a four-concentric-shell Ag@Au17@Ag27@Au17 structure. All phenylalkynyl (PA) ligands are linearly coordinated to the surface Au atoms with staple "PhC≡C-Au-C≡CPh" motif. Compared with reporte…

Chemical substanceIntermetallic02 engineering and technology010402 general chemistry01 natural sciencesBiochemistrycatalystsCatalysisCatalysisNanoclustersMetalHydrolysisColloid and Surface ChemistryPolymer chemistryCluster (physics)Organic chemistryta116intermetallic nanoclustersta114ChemistryphenylalkynylGeneral Chemistry021001 nanoscience & nanotechnology0104 chemical sciencessurface ligandsvisual_artvisual_art.visual_art_medium0210 nano-technologyScience technology and societyJournal of the American Chemical Society
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Syntheses, crystal structures, and magnetic properties of metal-organic hybrid materials of Mn(II)/Co(II): three-fold interpenetrated alpha-polonium-…

2014

Three new 1,4-phenylenediacrylate bridged Mn(II) and Co(II) complexes of molecular formulas {[Mn2(ppda)(phen)4(H2O)2](ppda)2(H2O)} (1), {[Co(ppda)- (dpyo)(H2O)3]·4(H2O)}n (2), and {[Co(ppda)(bpe)]·(0.5H2O)}n (3) [ppda = 1,4- phenylenediacrylate; phen = 1,10-phenanthroline; dpyo = 4,4′-dipyridyl N,N′-dioxide; bpe = 1,2-bis(4-pyridyl)ethane] have been synthesized and characterized by elemental analysis, IR spectra, single-crystal X-ray diffraction studies, and low-temperature magnetic measurements. The structural determination reveals that complex 1 is a discrete dinuclear species, 2 is a 1D polymeric chain, while 3 is a three-fold interpenetrated α-polonium network. Hydrogen-bonding interact…

Chemistry (all); Materials Science (all); Condensed Matter PhysicsChemistryInorganic chemistryChemistry (all)Supramolecular chemistryStackingInfrared spectroscopyAromaticityGeneral ChemistryCrystal structureCondensed Matter PhysicsLigandsMetalCrystallographyLligandsvisual_artvisual_art.visual_art_mediumMoleculeGeneral Materials ScienceMaterials Science (all)Hybrid materialEstructura cristal·lina (Sòlids)Layer structure (Solids)
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