Search results for "Susceptibility"

showing 10 items of 912 documents

A Binuclear MnIII Complex of a Scorpiand-Like Ligand Displaying a Single Unsupported MnIII–O–MnIII Bridge

2012

The crystal structure of a binuclear Mn(III) complex of a scorpiand-like ligand (L) displays an unsupported single oxo bridging ligand with a Mn(III)-O-Mn(III) angle of 174.7°. Magnetic susceptibility measurements indicate strong antiferromagnetic coupling between the two metal centers. DFT calculations have been carried out to understand the magnetic behavior and to analyze the nature of the observed Jahn-Teller distortion. Paramagnetic (1)H NMR has been applied to rationalize the formation and magnetic features of the complexes formed in solution.

Models MolecularManganeseMagnetic Resonance SpectroscopyChemistryLigandBridging ligandNuclear magnetic resonance spectroscopyCrystal structureCrystallography X-RayLigandsMagnetic susceptibilityInorganic ChemistryMetalCrystallographyParamagnetismCoordination Complexesvisual_artMagnetsvisual_art.visual_art_mediumProton NMRPhysical and Theoretical ChemistryOxygen CompoundsInorganic Chemistry
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Cubane-Type CuII4 and MnII2MnIII2 Complexes Based on Pyridoxine: A Versatile Ligand for Metal Assembling

2013

By using Vitamin B6 in its monodeprotonated pyridoxine form (PN-H) [PN = 3-hydroxy-4,5-bis(hydroxymethyl)-2-methylpyridine], two tetranuclear compounds of formula [Mn4(PN-H)4(CH3CO2)3Cl2]Cl·2CH3OH·2H2O (1) and [Cu4(PN-H)4Cl2(H2O)2]Cl2 (2) have been synthesized and magneto-structurally characterized. 1 crystallizes in the triclinic system with space group P1 whereas 2 crystallizes in the orthorhombic system with Fdd2 as space group. They exhibit Mn(II)2Mn(III)2 (1) and Cu(II)4 (2) cubane cores containing four monodeprotonated pyridoxine groups simultaneously acting as chelating and bridging ligands (1 and 2), three bridging acetate ligands in the syn-syn conformation (1), and two terminally …

Models MolecularManganeseMolecular StructureStereochemistryLigandPyridoxineTriclinic crystal systemLigandsMagnetic susceptibilitySquare pyramidal molecular geometryInorganic Chemistrychemistry.chemical_compoundCrystallographychemistryOctahedronCubaneOrganometallic CompoundsHydroxymethylOrthorhombic crystal systemPhysical and Theoretical ChemistryCopperInorganic Chemistry
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Field-induced slow relaxation of magnetisation in two one-dimensional homometallic dysprosium(iii) complexes based on alpha- and beta-amino acids.

2020

Two one-dimensional dysprosium(III) complexes based on α-glycine (gly) and β-alanine (β-ala) amino acids, with the formula {[Dy2(gly)6(H2O)4](ClO4)6·5H2O}n (1) and {[Dy2(β-ala)6(H2O)4](ClO4)6·H2O}n (2), have been synthesised and characterised structurally and magnetically. Both compounds crystallise in the triclinic system with the space group P. In 1, two DyIII ions are eight-coordinate and bound to six oxygen atoms from six gly ligands and two oxygen atoms from two water molecules, showing different geometries (bicapped trigonal prism and square antiprism). In 2, two DyIII ions are nine-coordinate and bound to seven oxygen atoms from six β-ala ligands and two oxygen atoms from two water m…

Models MolecularMolecular StructureMagnetic PhenomenaRelaxation (NMR)chemistry.chemical_elementTriclinic crystal systemCrystallography X-RayMagnetic susceptibilitySquare antiprismInorganic ChemistryCrystalCrystallographyMagnetizationchemistryCoordination ComplexesDysprosiumDysprosiumMoleculeAmino AcidsDalton transactions (Cambridge, England : 2003)
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Cubane-Type Mo3FeS44+,5+ Complexes Containing Outer Diphosphane Ligands: Ligand Substitution Reactions, Spectroscopic Studies, and Electronic Structu…

2012

A general protocol to access Mo(3)FeS(4)(4+) clusters selectively modified at the Fe coordination site is presented starting from the all-chlorine Mo(3)(FeCl)S(4)(dmpe)(3)Cl(3) (1) [dmpe = 1,2-bis(dimethylphosphane-ethane)] cluster and tetrabutylammonium salts (n-Bu(4)NX) (X = CN(-), N(3)(-), and PhS(-)). Clusters Mo(3)(FeX)S(4)(dmpe)(3)Cl(3) [X = CN(-) (2), N(3)(-) (3), and PhS(-) (4)] are prepared in high yield, and comparison of geometric and redox features upon modification of the coordination environment at the Fe site at parity of ligands at the Mo sites is also presented. The existence of the cubane-type Mo(3)FeS(4)(4+,5+) redox couple is demonstrated by cyclic voltammetry and for co…

Models MolecularPhosphinesIronInorganic chemistryMolecular ConformationElectronsInorganic chemicalsLigandsRedoxlaw.inventionInorganic Chemistrychemistry.chemical_compoundlawOrganometallic CompoundsReactionsDiphosphanePhysical and Theoretical ChemistryElectron paramagnetic resonanceMolybdenumLigandMagnetic PhenomenaSpectrum AnalysisDiphosphane ligandsMagnetic susceptibilityCrystallographychemistryCubaneQuantum TheoryDensity functional theoryCyclic voltammetryOxidation-ReductionSulfurInorganic Chemistry
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Use of a reduced Schiff-Base ligand to prepare novel chloro-bridged chains of rare Cu(II) trinuclear complexes with mixed azido/oxo and chloro/oxo br…

2010

Two mixed bridged one-dimensional (1D) polynuclear complexes, [Cu(3)L(2)(mu(1,1)-N(3))(2)(mu-Cl)Cl](n) (1) and {[Cu(3)L(2)(mu-Cl)(3)Cl].0.46CH(3)OH}(n) (2), have been synthesized using the tridentate reduced Schiff-base ligand HL (2-[(2-dimethylamino-ethylamino)-methyl]-phenol). The complexes have been characterized by X-ray structural analyses and variable-temperature magnetic susceptibility measurements. In both complexes the basic trinuclear angular units are joined together by weak chloro bridges to form a 1D chain. The trinuclear structure of 1 is composed of two terminal square planar [Cu(L)(mu(1,1)-N(3))] units connected by a central Cu(II) atom through bridging nitrogen atoms of end…

Models MolecularSchiff baseLigandStereochemistrychemistry.chemical_elementCrystallography X-RayLigandsChlorideMagnetic susceptibilityCopperInorganic Chemistrychemistry.chemical_compoundTrigonal bipyramidal molecular geometryCrystallographyMagneticschemistryAtommedicineHydrocarbons ChlorinatedOrganometallic CompoundsPhysical and Theoretical ChemistryCopperSchiff Basesmedicine.drugGroup 2 organometallic chemistryInorganic chemistry
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Isolation, characterization, and computational studies of the novel [Mo3(mu3-Br)2(mu-Br)3Br6]2- cluster anion.

2010

The novel trimolybdenum cluster [Mo(3)(mu(3)-Br)(2)(mu-Br)(3)Br(6)](2-) (1, {Mo(3)}(9+), 9 d-electrons) has been isolated from the reaction of [Mo(CO)(6)] with 1,2-C(2)H(4)Br(2) in refluxing PhCl. The compound has been characterized in solution by electrospray ionization mass spectrometry (ESI-MS), UV-vis spectroscopy, cyclic voltammetry, and in the solid state by X-ray analysis (counter-cations: (n-Bu)(4)N(+) (1), Et(4)N(+), Et(3)BzN(+)), electron paramagnetic resonance (EPR), magnetic susceptibility measurements, and infrared spectroscopy. The least disordered (n-Bu)(4)N(+) salt crystallizes in the monoclinic space group C2/c, a = 20.077(2) A, b = 11.8638(11) A, c = 22.521(2) A, alpha = 9…

Models MolecularSpectrometry Mass Electrospray IonizationElectrospray ionizationMolecular ConformationInfrared spectroscopychemistry.chemical_elementElectronsCrystallography X-RayVibrationlaw.inventionCoordination complexInorganic ChemistryMagneticslawCoordination ComplexesPhysical and Theoretical ChemistryElectron paramagnetic resonanceSpectroscopychemistry.chemical_classificationMolybdenumBromineChemistrySpectrum AnalysisMagnetic susceptibilityCrystallographyQuantum TheoryMonoclinic crystal systemInorganic chemistry
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Functional superoxide dismutase mimics. Structural characterization and magnetic exchange interactions of copper(II)-N-substituted sulfonamide dimer …

2004

Dinuclear copper(II) complexes with N-substituted sulfonamide ligands as superoxide dismutase (SOD) mimics have been investigated. The new N-(thiazol-2-yl)toluenesulfonamide (Htz-tol) and N-(thiazol-2-yl)naphthalenesulfonamide (Htz-naf) ligands have been prepared and structurally characterized. The complexes derived from these ligands, [Cu(2)(tz-tol)(4)] (1) and [Cu(2)(tz-naf)(4)] (2), have been synthesized, and their crystal structure, magnetic properties, and EPR spectra were studied in detail. In both compounds the metal centers are bridged by four nonlinear triatomic NCN groups. The coordination geometry of the coppers in the dinuclear entity of 1 and 2 is distorted square planar with t…

Models MolecularStereochemistryDimerMolecular Conformationchemistry.chemical_elementCrystal structureCrystallography X-RayLigandslaw.inventionInorganic Chemistrychemistry.chemical_compoundMagneticslawOrganometallic CompoundsMoleculePhysical and Theoretical ChemistryElectron paramagnetic resonanceCoordination geometrychemistry.chemical_classificationMolecular StructureChemistrySuperoxide DismutaseMolecular MimicryElectron Spin Resonance SpectroscopyCopperMagnetic susceptibilitySulfonamideCrystallographyAlgorithmsCopperInorganic chemistry
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An "S"-shaped pentanuclear CuII cluster derived from the metal-assisted hydrolysis of pyCOpyCOpy: structural, magnetic and spectroscopic studies.

2007

Reaction of [Cu2(O2CMe)4(H2O)2] with 2,6-di-(2-pyridylcarbonyl)-pyridine (pyCOpyCOpy or dpcp) in MeCN–H2O 10 : 1, led to the pentanuclear copper(II) complex [Cu5(O2CMe)6{pyC(O)(OH)pyC(O)(OH)py}2] (1) which crystallizes in the triclinic P space group. The copper(II) atoms are arranged in an “S”-shaped configuration, and are bridged by the doubly deprotonated bis(gem-diol) form of the ligand, pyC(O)(OH)pyC(O)(OH)py2−. Magnetic susceptibility data indicate the interplay of both ferro- and antiferromagnetic intramolecular interactions stabilizing an S = 3/2 ground state. Fitting of the data according to a next-nearest-neighbour model {Ĥ = −[J1(Ŝ1Ŝ2 + Ŝ1′Ŝ2′) + J2(Ŝ2Ŝ3 + Ŝ3′Ŝ2′) + J3(Ŝ1Ŝ3 + Ŝ3′Ŝ…

Models MolecularStereochemistryPyridineschemistry.chemical_elementTriclinic crystal systemCrystallography X-Raylaw.inventionInorganic ChemistryMagneticsDeprotonationlawOrganometallic CompoundsElectron paramagnetic resonanceMolecular StructureLigandHydrolysisSpectrum AnalysisHydrogen BondingCopperMagnetic susceptibilityCrystallographychemistryModels ChemicalIntramolecular forceGround stateCopperDalton transactions (Cambridge, England : 2003)
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Structural and magnetic investigations of the mixed-valence Fe(II,III) two-dimensional layer complex, [Fe2(II) Fe2(III)(HCOO)10(C6H7N)6]n.

2004

The structure of the complex, [Fe2(II)Fe2(III)(HCOO)10(C6H7N6)n, (1) exhibits a neutral two-dimensional layer network of alternating iron(II) and iron(III) ions, bridged equatorially by formate groups. All iron atoms are octahedrally coordinated, with iron(III) coordinating axially to one gamma-picoline and one formate group, while the iron(II) centers interact axially with two gamma-picoline groups, above and below the layer plane. The complex crystallizes in the triclinic space group P1 at all studied temperatures [at 120 K, the cell dimensions are: a = 10.228(1), b = 12.071(1), c = 12.072(1) A, alpha = 89.801(2), beta = 71.149(2), gamma = 73.371(2) degrees]. An intralayer antiferromagnet…

Models MolecularValence (chemistry)ChemistryStereochemistryExchange interactionTemperatureCrystal structureTriclinic crystal systemCrystallography X-RayMagnetic susceptibilityFerric CompoundsAtomic and Molecular Physics and OpticsCrystallographyMagneticsSpectroscopy MossbauerMössbauer spectroscopyOrganometallic CompoundsAntiferromagnetismMoleculeFerrous CompoundsPhysical and Theoretical ChemistryChemphyschem : a European journal of chemical physics and physical chemistry
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A Tetracopper(II)-Tetraradical Cuboidal Core and Its Reactivity as a Functional Model of Phenoxazinone Synthase

2007

The coordination chemistry of the tridentate ligand N-(2-hydroxy-3,5-di-tert-butylphenyl)-2-aminobenzylalcohol H3L has been studied with the copper(II) ion. The ligand is noninnocent in the sense that it is readily oxidized in the presence of air to its o-iminobenzosemiquinonato [L*]2- radical form. The crystal structure of the synthesized tetracopper(II)-tetraradical complex [CuII4(L*)4] (1), has been determined by X-ray crystallography at 100 K. Variable-temperature (2-290 K) magnetic susceptibility measurements of complex 1 containing eight paramagnetic centers establish the spin ground state to be diamagnetic (St=0) arising from the antiferromagnetic interactions. Electrochemical measur…

Models Molecularchemistry.chemical_classificationSpectrometry Mass Electrospray IonizationMagnetic Resonance SpectroscopySpectrophotometry InfraredLigandChemistryStereochemistryCrystal structureCrystallography X-RayMagnetic susceptibilityCoordination complexInorganic ChemistryMetalMagneticsCrystallographyParamagnetismvisual_artElectrochemistryvisual_art.visual_art_mediumAntiferromagnetismReactivity (chemistry)Physical and Theoretical ChemistryOxidoreductasesCopperInorganic Chemistry
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