Search results for "Ordination"

showing 10 items of 1367 documents

Crystal polymorphism of (μ4–O)-body centered adamantanoid Cu(II) complexes

2016

Abstract Two novel polymorphs of [Cu4(μ4–O)(μ–Cl)6(DASO)4], (DASO = diallyl sulfoxide; C6H10OS), rhombic (C) and triclinic (D), were obtained and examined by single crystal X-ray diffraction analysis at two temperatures, 295(2) and 100(1) K. This study, in addition to our recent work on the tetragonal (A) and trigonal (B) forms of the title compound, allowed determining the nature of polymorphism and temperature-induced phase transitions. It is stated that both the packing arrangement and the displacive transformation integrate these structures, forming the symmetrically and thermodynamically related series: A,B → C → D. The C3h → C4 distortion of Cu(II) trigonal bipyramidal coordination ge…

Phase transitionO-body centered adamantanoid cageChemistryOrganic ChemistryTriclinic crystal system010403 inorganic & nuclear chemistry01 natural sciences0104 chemical sciencesAnalytical ChemistryInorganic ChemistryTrigonal bipyramidal molecular geometryCrystallographyTetragonal crystal systemCu(II) coordination sphere distortionPolymorphism (materials science)Diffusionless transformation0103 physical sciences010306 general physicsSingle crystalSpectroscopyPacking and displacive polymorphismCoordination geometryorder–disorder transformationJournal of Molecular Structure
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Magnetism and variable temperature and pressure crystal structures of a linear oligonuclear cobalt bis-semiquinonate

2016

The crystal structure of the first oligomeric cobalt dioxolene complex, Co3(3,5-DBSQ)2((t)BuCOO)4(NEt3)2, 1, where DBSQ is 3,5-di-tert-butyl-semiquinonate, has been studied at various temperatures between 20 and 200 K. Despite cobalt-dioxolene complexes being generally known for their extensive ability to exhibit valence tautomerism (VT), we show here that the molecular geometry of compound 1 is essentially unchanged over the full temperature range, indicating the complete absence of electron transfer between ligand and metal. Magnetic susceptibility measurements clearly support the lack of VT between 8 and 300 K. The crystal structure is also determined at elevated pressures in the range f…

Phase transitionValence (chemistry)010405 organic chemistryChemistryCrystal structure010402 general chemistry01 natural sciencesMagnetic susceptibility0104 chemical sciencesInorganic ChemistryCrystallographyTrigonal bipyramidal molecular geometryElectron transferMolecular geometryCoordination geometryDalton Transactions
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Cooperative phenomena and light-induced bistability in iron(II) spin-crossover compounds

1999

In iron(II) spin-crossover compounds, the transition from the 1A1 low-spin state at low temperatures to the 5T2 high-spin state at elevated temperatures is accompanied by a large increase in metal-ligand bond lengths. The resulting elastic interactions may be pictured as an internal pressure which is proportional to the concentration of the low-spin species. Because pressure stabilises the low-spin state relative to the high-spin state this results in a positive feedback. Thermal transition curves in neat iron(II) spin-crossover compounds are thus invariable much steeper than in diluted mixed crystals, and the high-spin→low-spin relaxation following the light-induced population of the high-…

Phase transitioneducation.field_of_studyCooperative effectsCondensed matter physicsBistabilityChemistryRelaxation (NMR)PopulationInternal pressureIron(II) coordination compoundsLIESSTInorganic ChemistryChemical physicsSpin crossoverddc:540Materials ChemistryHigh-spinlow-spin relaxationCondensed Matter::Strongly Correlated ElectronsBistabilityPhysical and Theoretical ChemistrySpin-crossoverGround stateeducationCoordination Chemistry Reviews
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Synthesis of ortho-fonctionnalized arylphosphines and their applications

2020

This thesis reports with the synthesis of ortho-functionnalized phosphines bearing phosphonium and 1,2,3-triazole moieties.The synthesis of phosphines-phosphoniums, using as key-step Phospha-Fries rearrangement and Appel reaction is described. Eight new phosphines- phosphoniums, bearing aryl, alkyl or ferrocenyl fragments on the phosphonium part, have been prepared with overall yields reaching 48%. These phosphines- phosphoniums have been used in the preparation of gold (I) complexes which have been characterized using spectroscopic methods and X ray diffraction. Both gold (I) complexes and phosphines-phosphoniums have been studied in biology and these compounds turned out to be cytotoxic i…

Phosphines ortho-FonctionnaliséesPhosphines-Triazoles P-ChirogéniquesCatalyse asymétriqueP-Chirogenic phosphines-TriazolesAsymmetric catalysis[CHIM.CRIS]Chemical Sciences/CristallographyOrtho-Fonctionnalized phosphinesPhosphines-PhosphoniumsComplexes d’or (I)[CHIM.CRIS] Chemical Sciences/CristallographyGold (I) complexesChimie de coordinationCoordination chemistry
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DNA-binding and in vitro cytotoxic activity of platinum(II) complexes of curcumin and caffeine

2019

Abstract Three Pt(II) complexes containing the natural ligands curcumin and caffeine, namely [Pt(curc)(PPh3)2]Cl (1), [PtCl(curc)(DMSO)] (2) (curc = deprotonated curcumin) and trans-[Pt(caffeine)Cl2(DMSO)] (3), were synthesized and fully characterized. The data obtained suggest that, for both 1 and 2, the anion of curcumin is coordinated to the platinum ion via the oxygen atoms of the β-diketonate moiety. Spectroscopic features reveal that in 2 and 3, a DMSO molecule is S-bonded to the metal centre. For 3, all data indicate a square-planar geometry formed by a 9-N bonded caffeine, two trans chloride anions and a DMSO. The three complexes undergo changes in solution upon incubation for 24 h;…

PhotoactivationCurcuminCytotoxicityIntercalation (chemistry)chemistry.chemical_elementCaffeine; Curcumin; Cytotoxicity; DNA interaction; Natural ligands; Photoactivation; Platinum(II) complexAntineoplastic Agents010402 general chemistryLigands01 natural sciencesBiochemistryMedicinal chemistryNucleobaseInorganic Chemistrychemistry.chemical_compoundDrug StabilityCoordination ComplexesCaffeineCell Line TumorMoietyMoleculeAnimalsHumansPlatinumMolecular Structure010405 organic chemistryDNA0104 chemical sciencesDNA interactionchemistryCurcuminPlatinum(II) complexCattleCaffeine Curcumin Cytotoxicity DNA interaction Natural ligands Photoactivation Platinum(II) complexCisplatinDrug Screening Assays AntitumorSelectivityPlatinumNatural ligandsCis–trans isomerism
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Clathration of Five-Membered Aromatic Rings in the Bimetallic Spin Crossover Metal–Organic Framework [Fe(TPT)2/3{MI(CN)2}2]·G (MI = Ag, Au)

2014

Six clathrate compounds of the three-dimensional spin crossover metal−organic framework formulated [Fe(TPT)2/3{MI (CN)2}2]· nG, where TPT is 2,4,6-tris(4-pyridyl)-1,3,5-triazine, MI = Ag or Au and G represent the guest molecules furan, pyrrole and thiophene, were synthesized using slow diffusion techniques. The clathrate compounds were characterized by single-crystal X-ray diffraction at 120 and 300 K, thermogravimetric analysis and thermal dependence of the magnetic susceptibility. All compounds crystallize in the R3̅ m trigonal space group. The FeII defines a unique [FeN6] crystallographic site with the equatorial positions occupied by four dicyanometallate ligands while the axial positio…

PhotochemistryIron (ii) complexeschemistry.chemical_compoundPorous coordination polymersSpin crossoverFuranPressureThiopheneMoleculeGeneral Materials ScienceModulationBehaviorTransition-temperatureLigandAromaticityGeneral ChemistryCondensed Matter PhysicsMolecular materialsCrystallographychemistryFISICA APLICADAMetal-organic frameworkBistabilityNetworksStateNatural bond orbitalCrystal Growth & Design
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Photochemical intermediates of trans-Rh(CO)L2Cl where L=PMe3, PBu3, and i-Pr2HN and cis-Rh(CO)2(i-Pr2HN)Cl in frozen organic glasses

2002

International audience; The Nujol glass matrix photolyses of Rh(CO)(PMe3)2Cl (1), Rh(CO)(PBu3)2Cl (2), Rh(CO)2(i-Pr2HN)Cl (3), and Rh(CO)(i-Pr2HN)2Cl (4), have been examined. Phototolysis of 1 (λirr>400 nm) and 2 (350<λirr<400 nm) give new species, A, with carbonyl stretching bands slightly below the parent bands. In the case of 1 this species appears to give rise to a second product, C, upon either extended photolysis or annealing. High-energy photolysis of 1, 2, and 4, result in loss of CO and formation of an IR silent species, RhL2Cl. In the case of 1 a new carbonyl species, B, is observed upon high-energy photolysis or annealing of a matrix containing CO and Rh(PMe3)2Cl. B may be conver…

Photolysis010405 organic chemistryChemistryAnnealing (metallurgy)Organic ChemistryPhotodissociationAmine derivatives010402 general chemistryPhotochemistryGlass matrix01 natural sciencesBiochemistry0104 chemical sciencesInorganic ChemistryDFT analysischemistry.chemical_compoundNujolExcited stateMaterials Chemistry[CHIM.COOR]Chemical Sciences/Coordination chemistryPhysical and Theoretical ChemistryPhosphineAmine derivativesJournal of Organometallic Chemistry
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Making Telescopes and Partying with the Stars: Amateur Astronomy in Spain during Franco’s Dictatorship

2016

Franco’s dictatorship was characterized by an official narrative that criminalized the liberal tradition of previous periods. Such a discourse defined an ideologically correct science that censured the subordination of Spanish science to foreign influence and sought to create a new scientific tradition. However, recent studies have revised these aims and suggest that there was a continuity of scientific and technological programmes and practices before and after the Spanish Civil War. This paper contributes to these investigations with further evidence, focusing on several practices that characterized the development of amateur astronomy during this period. Special attention is paid to the…

Physics and Astronomy (miscellaneous)media_common.quotation_subjectSocialization (Marxism)AstronomyAstronomy and AstrophysicsDictatorshipAssociationismSubordination (finance)Spanish Civil WarArts and Humanities (miscellaneous)Political scienceNarrativeIdeologyAmateurmedia_commonJournal for the History of Astronomy
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Superparamagnetism in Ising Clusters

1992

Recent experiments on small ferromagnetic clusters have inspired introduction of a number of seemingly quite different theoretical models. We shall argue that all these models show superparamagnetic behaviour above the blocking temperature but below the Curie temperature. In particular, we shall show that Ising clusters display superparamagnetism and introduce a simple correction to the usual tank behaviour of magnetisation which has to be included for very small clusters. We also discuss the dependence of magnetisation on coordination number.

PhysicsCondensed Matter::Materials ScienceMagnetizationCondensed matter physicsFerromagnetismCoordination numberTheoretical modelsCurie temperatureCondensed Matter::Strongly Correlated ElectronsIsing modelSuperparamagnetism
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Dynamic Self-assembly of Non-Brownian Spheres.

2017

International audience; Granular self-assembly of confined non-Brownian spheres under gravity is studied by Molecular Dynamics simulations. Starting from a disordered phase, dry or cohesive spheres organize, by vibrational an-nealing into BCT or FCC structures, respectively. During the self-assembling process, isothermal and isodense points are observed. The existence of such points indicates that both granular temperature and packing fraction undergo an inversion process. Around the isothermal point, a sudden growth of beads having the maximum coordination number takes place. We show by a density fluctuation analysis that a transition form a disordered phase to a crystalline structure may …

PhysicsCondensed matter physicsCoordination numberPhysicsQC1-999Crystal structureAtomic packing factor01 natural sciencesIsothermal process010305 fluids & plasmasMolecular dynamics0103 physical sciencesSPHERESSelf-assemblyStatistical physics[PHYS.COND.CM-SM]Physics [physics]/Condensed Matter [cond-mat]/Statistical Mechanics [cond-mat.stat-mech]010306 general physicsBrownian motionEPJ Web of Conferences
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