Search results for "spin [structure function]"

showing 10 items of 1132 documents

Remarkable Steric Effects and Influence of Monodentate Axial Ligands L on the Spin-Crossover Properties of trans-[FeII(N4 ligand)L] Complexes

2007

Iron(II) complexes obtained from tetradentate, rigid, linear N4 ligands have been investigated to appraise the influence of steric effects and the impact of trans-coordinated anions on the spin-transition behavior. As expected, the well-designed ligands embrace the metal center, resulting in octahedral iron(II) complexes where the basal plane is fully occupied by the pyridine/pyrazole N4 ligand, while anions or solvent molecules are exclusively axially coordinated. Precursor complexes, namely, [Fe(bpzbpy)(MeOH)2](BF4)2 (where bpzbpy symbolizes the ligand 6,6'-bis(N-pyrazolylmethyl)-2,2'-bipyridine) and [Fe(mbpzbpy)(MeOH)2](BF4)2 (where mbpzbpy symbolizes the ligand 6,6'-bis(3,5-dimethyl-N-p…

Steric effectsDenticityTetradentate ligandThiocyanateMössbauer spectroscopy010405 organic chemistryLigandStereochemistry[CHIM.MATE]Chemical Sciences/Material chemistryIron complexesPyrazoleSpin crossover010402 general chemistry01 natural sciences0104 chemical sciencesInorganic Chemistrychemistry.chemical_compoundCrystallographychemistrySpin crossoverPyridinePhysical and Theoretical ChemistryDicyanamideInorganic Chemistry
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Gold(I) Complexes of Ferrocenyl Polyphosphines: Aurophilic Gold Chloride Formation and Phosphine-Concerted Shuttling of a Dinuclear [ClAu···AuCl] Fra…

2016

International audience; A smart steric control of the metallocene backbone in bis- and poly(phosphino)ferrocene ligands favors intramolecular aurophilic interactions between [AuCl] fragments in polynuclear gold(I) complexes. We synthesized and characterized by multinuclear NMR and X-ray diffraction analysis mono-, di-, and polynuclear gold complexes of constrained ferrocenyl diphosphines, which bear either bulky tert-butyl groups or more flexible siloxane substituents at the cyclopentadienyl rings. The complexes meso-1,1'-bis-(diphenylphosphino)-3,3'-di-tert-butylferrocene (4-m), rac-1,1'-bis[bis-(5-methy1-2-furyl)phosphino]-3,3'-di-tert-butyfferrocene (5-r), and rac-1,1'-bis ( diphenylphos…

Steric effectsbasis-setscoordination-complexesStereochemistry[CHIM.INOR]Chemical Sciences/Inorganic chemistry010402 general chemistry01 natural sciencesMedicinal chemistryInorganic Chemistrytopological analysischemistry.chemical_compoundelectron localizationCyclopentadienyl complexantitumor-activityDiphosphinesmolecular-orbital methodsPhysical and Theoretical Chemistryx-ray-structurep-31 nmr010405 organic chemistryLigandcrystal-structure[ CHIM.INOR ] Chemical Sciences/Inorganic chemistryspin couplings0104 chemical scienceschemistryFerroceneIntramolecular forceMetallocenePhosphine
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Tunable Spin-Crossover Behavior of the Hofmann-like Network {Fe(bpac)[Pt(CN) 4 ]} through Host-Guest Chemistry

2013

A study of the spin-crossover (SCO) behavior of the tridimensional porous coordination polymer {Fe(bpac)[Pt(CN)4]} (bpac=bis(4-pyridyl) acetylene) on adsorption of different mono- and polyhalobenzene guest molecules is presented. The resolution of the crystal structure of {Fe(bpac)[Pt(CN) 4]}A?G (G=1,2,4-trichlorobenzene) shows preferential guest sites establishing I?A?A?A?I? stacking interactions with the host framework. These host-guest interactions may explain the relationship between the modification of the SCO behavior and both the chemical nature of the guest molecule (electronic factors) and the number of adsorbed molecules (steric factors). Copyright © 2013 WILEY-VCH Verlag GmbH & …

Steric effectsclathrates010405 organic chemistryCoordination polymerStereochemistryOrganic Chemistryhost–guest systemsStackingGeneral ChemistryCrystal structure010402 general chemistrystacking interactions01 natural sciencesCatalysis0104 chemical scienceschemistry.chemical_compoundCrystallographymetal–organic frameworkschemistryspin crossoverSpin crossoverMoleculeMetal-organic framework[CHIM.COOR]Chemical Sciences/Coordination chemistryHost–guest chemistry
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Dynamic anomaly in the glass transition region of orthoterphenyl

1991

We report on incoherent and coherent neutron scattering results in the supercooled liquid and the glassy regime of the van der Waals fluido-terphenyl using the backscattering and spin echo technique, respectively. A critical comparison of both techniques is presented. The data are analysed in the time domain assuming that microscopic correlation times (τ) scale with the viscosity η according to τ(T)∼η(T)/T. With this assumption we obtain an agreement with several predictions of mode coupling theory: the existence of a critical temperatureT c is shown, independently for both incoherent and coherent data, by a cusp in the temperature dependence of the Debye-Waller factorf Q (T). BelowT c fQ(T…

Stretched exponential functionPhysicsCondensed matter physicsNeutron scatteringCondensed Matter PhysicsPower lawElectronic Optical and Magnetic Materialssymbols.namesakeSpin echosymbolsRelaxation (physics)General Materials ScienceAnomaly (physics)Debye–Waller factorvan der Waals forceZeitschrift f�r Physik B Condensed Matter
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Ascorbic Acid Oxidation in Sucrose Aqueous Model Systems at Subzero Temperatures

2004

The reduction of Tempol by ascorbic acid in concentrated sucrose solutions was measured by electron paramagnetic resonance (EPR) at temperatures ranging from 16 to −16 °C. This method allowed the determination of the rate constants (k) of this fast reaction, by recording the Tempol reduction as a function of time. The two reactants were initially separated and had to migrate for the reaction to occur. The experimental findings were compared with predicted values according to the equation for diffusion-controlled reaction proposed by Atkins. The experimental reaction rate constants were observed to be lower than the calculated ones. However, the experimental values were found to be controlle…

SucroseSucroseReactionDiffusionAnalytical chemistryAscorbic Acid010402 general chemistry01 natural scienceslaw.inventionCyclic N-OxidesReaction rate[SPI]Engineering Sciences [physics]chemistry.chemical_compoundViscosityReaction rate constantlawFreezing0103 physical sciencesVitamin CElectron paramagnetic resonanceAqueous solution010304 chemical physicsdiffusionElectron Spin Resonance SpectroscopyTemperatureWaterTempolNegative temperaturesGeneral ChemistryAscorbic acid0104 chemical sciencesSolutionsKineticschemistryBiochemistrySpin LabelsElectron paramagnetic resonanceGeneral Agricultural and Biological SciencesOxidation-ReductionCryoconcentrationJournal of Agricultural and Food Chemistry
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Triggering the generation of an iron(IV)-oxo compound and its reactivity toward sulfides by RuII photocatalysis

2014

The preparation of [FeIV(O)(MePy2tacn)]2+ (2, MePy2tacn = N-methyl-N,N-bis(2-picolyl)-1,4,7-triazacyclononane) by reaction of [FeII(MePy2tacn)(solvent)]2+ (1) and PhIO in CH3CN and its full characterization are described. This compound can also be prepared photochemically from its iron(II) precursor by irradiation at 447 nm in the presence of catalytic amounts of [Ru II(bpy)3]2+ as photosensitizer and a sacrificial electron acceptor (Na2S2O8). Remarkably, the rate of the reaction of the photochemically prepared compound 2 toward sulfides increases 150-fold under irradiation, and 2 is partially regenerated after the sulfide has been consumed; hence, the process can be repeated several times.…

SulfideFotocatàlisi010402 general chemistryPhotochemistry01 natural sciencesBiochemistryChemical reactionArticleCatalysisCatalysisReaccions químiquesReaction rateColloid and Surface ChemistrySofre -- CompostosChemical reactionsSulphur compoundsOrganic chemistryWATER[CHIM.COOR]Chemical Sciences/Coordination chemistryPhotosensitizerReactivity (chemistry)Photocatalysischemistry.chemical_classificationOXYGENATION REACTIONS010405 organic chemistryChemistryGeneral ChemistryElectron acceptorSTATE0104 chemical sciencesELECTRON-TRANSFER PROPERTIESC-H OXIDATIONSPIN FE(IV) COMPLEXPhotocatalysisIRON-OXO COMPLEXESLIGANDTAURINE/ALPHA-KETOGLUTARATE DIOXYGENASENONHEME OXOIRON(IV) COMPLEXES
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DNA cleavage reaction induced by dimeric copper(II) complexes of N-substituted thiazole sulfonamides

2005

A new dinuclear copper(II) complex has been synthesised and structurally characterised: [Cu2(tz-ben)4] (Htz-ben = N-thiazol-2-yl-benzenesulfonamide). Its crystal structure, magnetic properties and electronic paramagnetic resonance (EPR) spectra were studied in detail. In the compound the metal centres are bridged by four non-linear triatomic NCN groups. The coordination geometry of the copper ions in the dinuclear entity is distorted square pyramidal (4+1). Two thiazole N and two sulfonamido N atoms occupy the equatorial positions and one sulfonamido O atom is in the axial position. Magnetic susceptibility data show a strong antiferromagnetic coupling, -2J = 114.1 cm(-1). The EPR spectra of…

SulfonamidesSpectrophotometry InfraredStereochemistryElectron Spin Resonance SpectroscopyDNACrystal structureZero field splittingCrystallography X-RayBiochemistryMagnetic susceptibilityMass SpectrometrySquare pyramidal molecular geometrylaw.inventionInorganic ChemistryThiazolesCrystallographychemistry.chemical_compoundchemistrylawOrganometallic CompoundsSinglet stateThiazoleElectron paramagnetic resonanceCopperCoordination geometryJournal of Inorganic Biochemistry
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A novel paramagnetic molecular superconductor formed by bis(ethylenedithio)tetrathiafulvalene, tris(oxalato)ferrate(iii) anions and bromobenzene as g…

2005

The new paramagnetic molecular superconductor ET4[(H3O)Fe(C2O4)3]·C6H5Br (1) (Tc = 4.0 K) contains layers of superconducting ET donors alternating with paramagnetic hexagonal layers formed by (H3O)+, [Fe(C2O4)3]3− and guest C6H5Br molecules located in the hexagonal cavities. Conductivity measurements show metallic behavior from room temperature with a minimum in the resistivity at ca. 50 K followed by a smooth increase and a sharp drop in the resistivity with an onset at 4.0 K and a zero resistance at ca. 1.0 K. Magnetoresistance measurements indicate that Hc1 is about 7 mT and that Hc2 is very anisotropic (Hc2⊥ ≥ 5.5 T and Hc2|| ≈ 0.5 T). Magnetic susceptibility measurements show the expec…

SuperconductivityCondensed matter physicsSpin statesMagnetoresistanceGeneral ChemistryMagnetic susceptibilityParamagnetismchemistry.chemical_compoundCrystallographyTransition metalchemistryMeissner effectMaterials ChemistryTetrathiafulvaleneJ. Mater. Chem.
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Transport anisotropy and of thin films

2005

Abstract The resistivity R ( T ) of superconducting UNi 2 Al 3 thin films shows a pronounced dependence on the current direction. Specifically, the superconducting transition temperature T c is directional dependent as well as the influence of the magnetic ordering on the transport properties. Also the upper critical field B c 2 ( Θ , T ) is moderately influenced by the probe current direction. These anisotropies are discussed in the framework of multiband superconductivity. The initial slope of the upper critical field B c 2 ′ ( T ) provides evidence for a spin singlet state.

SuperconductivityMaterials scienceSpin statesCondensed matter physicsCondensed Matter PhysicsElectronic Optical and Magnetic MaterialsElectrical resistivity and conductivityCondensed Matter::SuperconductivitySinglet stateElectrical and Electronic EngineeringThin filmCurrent (fluid)AnisotropyCritical fieldPhysica B: Condensed Matter
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A penetration depth study on the non-centrosymmetric superconductors Li2(Pd1−xPtx)3B

2008

Abstract We study the superconducting order parameter in the non-centrosymmetric compounds Li 2 (Pd 1− x Pt x ) 3 B ( x =0, 0.3, 0.7 and 1) by measuring magnetic penetration depth λ ( T ). The low temperature λ ( T ) shows a linear temperature dependence for x ⩾0.3, but follows exponential-like behavior for lower Pt contents. These findings suggest that a spin-triplet state might gradually develop with increasing x due to the broken inversion symmetry.

SuperconductivityMaterials scienceSpin statesCondensed matter physicsPoint reflectionSymmetry breakingSpin–orbit interactionElectrical and Electronic EngineeringTriplet stateCondensed Matter PhysicsPenetration depthElectronic Optical and Magnetic MaterialsPhysica B: Condensed Matter
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