Search results for "none"

showing 10 items of 1921 documents

Slow Relaxation of the Magnetization in Anilato-Based Dy(III) 2D Lattices.

2021

The search for two- and three-dimensional materials with slow relaxation of the magnetization (single-ion magnets, SIM and single-molecule magnets, SMM) has become a very active area in recent years. Here we show how it is possible to prepare two-dimensional SIMs by combining Dy(III) with two different anilato-type ligands (dianions of the 3,6-disubstituted-2,5-dihydroxy-1,4-benzoquinone: C6O4X22−, with X = H and Cl) in dimethyl sulfoxide (dmso). The two compounds prepared, formulated as: [Dy2(C6O4H2)3(dmso)2(H2O)2]·2dmso·18H2O (1) and [Dy2(C6O4Cl2)3(dmso)4]·2dmso·2H2O (2) show distorted hexagonal honeycomb layers with the solvent molecules (dmso and H2O) located in the interlayer space and…

Dy(III)Models Molecularhoneycomb structureMaterials sciencePharmaceutical ScienceCrystal structureArticleAnalytical Chemistrylcsh:QD241-441chemistry.chemical_compoundMagnetizationFI-SIMlcsh:Organic chemistryCoordination ComplexesDrug DiscoveryBenzoquinonesDysprosiumMoleculePhysical and Theoretical ChemistryMolecular StructureDimethyl sulfoxideOrganic ChemistryRelaxation (NMR)SIMSMMSolventCrystallographychemistrylayered materialsChemistry (miscellaneous)MagnetMolecular MedicineDerivative (chemistry)anilato ligandsMolecules (Basel, Switzerland)
researchProduct

Ontologías para servicios web semánticos de información de tráfico: descripción y herramientas de explotación.

2005

Esta tesis forma parte de los denominados Sistemas Inteligentes de Tráfico (ITS) los cuales se basan en la aplicación de tecnologías de Telecomunicaciones e Informática (Telemática) a los sistemas de ayuda al tráfico vial, perteneciendo al dominio "Servicios de Información al Viajero" (TIS).Como se pone de manifiesto, existen algunos problemas derivados del uso de este tipo de sistemas, desde el punto de vista del usuario, que dan lugar a que éste sea incapaz de obtener la información clara y precisa correspondiente a sus requerimientos.Los principales problemas identificados han sido la falta de un vocabulario común de términos que haga uso de una semántica bien definida que permita obtene…

E.S.T. Ingenierianone004
researchProduct

Antitumor Effect of Glandora rosmarinifolia (Boraginaceae) Essential Oil through Inhibition of the Activity of the Topo II Enzyme in Acute Myeloid Le…

2022

It was previously shown that the antitumor and cytotoxic activity of the essential oil (EO) extracted from the aerial parts of Glandora rosmarinifolia appears to involve a pro-oxidant mechanism in hepatocellular carcinoma (HCC) and in triple-negative breast cancer (TNBC) cell lines. Its most abundant compound is a hydroxy-methyl-naphthoquinone isomer. Important pharmacological activities, such as antitumor, antibacterial, antifungal, antiviral and antiparasitic activities, are attributed to naphthoquinones, probably due to their pro-oxidant or electrophilic potential; for some naphthoquinones, a mechanism of action of topoisomerase inhibition has been reported, in which they appear to act b…

EOs; napthoquinone; Topo II; multidrug resistancenapthoquinonemultidrug resistanceChemistry (miscellaneous)EOOrganic ChemistryDrug DiscoverySettore BIO/14 - FarmacologiaMolecular MedicinePharmaceutical ScienceTopo IIPhysical and Theoretical ChemistryAnalytical ChemistryMolecules
researchProduct

Development of eco-friendly processes for the synthesis of biobased solvents and organocatalysts

2018

Oxazolidinones are promising compounds for industrial applications, but nowadays there is not convenient method to produce them on large scale, because of the use of reactants and metallic catalysts harmful for health and environment. A new synthesis method of these compounds was thus elaborated using aminoalcohols and diethyl carbonate. This reaction is catalysed by a biobased imidazolium hydrogen carbonate which is produced by an electrochemical pathway in order to reduce its impact on the environment.This oxazolidinones synthesis method was then applied to the synthesis of a biobased oxazolidinone. To achieve this, an aminoalcohol synthesis was realised, and its structure was established…

Ecodesign[CHIM.OTHE] Chemical Sciences/OtherDéveloppement durableSustainable developmentLife cycleImidazoliumCycle de vieBiosourcé[CHIM.OTHE]Chemical Sciences/OtherBiobasedOxazolidinoneÉcoconception
researchProduct

Loss of a freshwater copepod species from El Junco Lake, Galápagos following the introduction and eradication of the Nile tilapia

2021

An undescribed diaptomid copepod probably belonging to a new Mastigodiaptomus species has been discovered and was very abundant in El Junco Lake (San Cristóbal Island, Ecuador) from 1966 until 2004. The species was not found in samples from 2007, 2008 or 2018. The loss of this key species from the lake coincides with the illegal introduction of Nile tilapia to El Junco Lake in 2005 and its subsequent eradication in 2008. The disappearance of this biogeographically and ecologically important copepod population may be explained by direct mechanisms of predation and competition, by a combination of both processes, and by indirect mechanisms linked to alterations in the lake ecosystem. The effe…

EcologybiologyOreochromiscopepodbiological invasionsSettore BIO/05 - ZoologiaZoologynon-native speciesAquatic Sciencebiology.organism_classificationInvasive speciesPREDAÇÃO (BIOLOGIA)rotenoneOreochromisNile tilapiaGeographynon-native fishJuncoDiaptomidCopepodNature and Landscape Conservation
researchProduct

Electrochemical reduction and carboxylation of halobenzophenones

2002

Abstract The electrochemical reduction of a series of halogenated benzophenones XC6H4COC6H4Y (1) was studied in aprotic solvents, in the absence and presence of CO2, by cyclic voltammetry (CV) and controlled-potential electrolysis. The mechanism of electroreduction in dimethylformamide (DMF) has been investigated in some detail. Most of the compounds undergo reductive carbonhalogen bond cleavage in the time window of CV. The radical anions derived from difluorobenzophenones (X=Y=4-F; X=2-F, Y=4-F) as well as from the 3-chloro derivative are quite stable with a cleavage rate constant (kc) of the order of 10−2 s−1 or less. With 4-chloro-, 2-chloro-, 4,4′-dichloro- and 2,4′-dichorobenzophen…

ElectrolysishydroxyacidChemistryGeneral Chemical EngineeringInorganic chemistryElectrochemicalreductionReaction intermediateElectrochemistryAnalytical Chemistrylaw.inventioncarboxylationchemistry.chemical_compoundhalobenzophenoneReaction rate constantCarboxylationlawElectrochemistryDimethylformamideCyclic voltammetryBond cleavage
researchProduct

Theoretical study on the molecular mechanism of the [5 + 2] vs. [4 + 2] cyclization mediated by Lewis acid in the quinone system

2013

[EN] The thermal and Lewis acid (LA) catalyzed cyclizations of quinone 1 involved in the synthesis of Colombiasin A and Elipsaterosin B have been theoretically studied using DFT methods at the B3LYP/6-311G(d,p) computational level. B3LYP calculations suggest that the formal endo [4 + 2] cycloadduct allowing the synthesis of Colombiasin A is preferentially formed under thermal conditions, while in the presence of the BF3 LA catalyst the formal [5 + 2] cycloadduct is seen, allowing the synthesis of Elipsaterosin B. The BF3 LA catalyst not only accelerates the nucleophilic attack on the C2 carbon of the quinone framework through a more polar C-C bond formation, but also provokes a different el…

Electron localization functionChemistryStereochemistryOrganic ChemistryCycloaddition reactionBiochemistryCatalysisQuinoneNucleophileDiels-alder reactionIntramolecular forceElf analysis(-) Elisapterosin-BElectrophilePolarizable continuum modelSingle bondLewis acids and bases(-) Colombiasin-APhysical and Theoretical ChemistryTopological analysisBond formationDiels–Alder reactionOrganic & Biomolecular Chemistry
researchProduct

Temperature dependence of the isotropic hyperfine coupling constants in 1,4-hydroquinone and 1,4-dihydroxynaphthalene cation radicals

1998

Electron paramagnetic resonance spectroscopyHyperfine couplingchemistry.chemical_compoundHydroquinoneChemistryComputational chemistryRadicalIsotropyPhysical chemistryGeneral Materials ScienceGeneral ChemistryMagnetic Resonance in Chemistry
researchProduct

Decreased Electron Transfer Rates of Manganese Porphyrins with Conformational Distortion of the Macrocycle

1998

Slow electron transfer to manganese(iii) porphyrins results when the macrocycle deviates from planarity. This was demonstrated by measuring the kinetics of homogeneous electron transfer from a series of semiquinone radical anions to synthetic manganese porphyrins (shown schematically; R1 =H, Cl, F; R2 =H, F). Three of the four porphyrins studied have nonplanar macrocycles. These results could have implications for the role of manganese in biological electron transfer processes.

Electron transferchemistrySemiquinoneHomogeneousKineticschemistry.chemical_elementGeneral ChemistryManganesePhotochemistryCatalysisPlanarity testingAngewandte Chemie International Edition
researchProduct

Biomimetic oxidation of pyrene and related aromatic hydrocarbons. Unexpected electron accepting abilities of pyrenequinones

2014

We present a mild catalytic method to oxidize PAHs and, in particular, pyrene. The pyrenediones are much better electron acceptors than benzoquinone in the gas phase and present similar accepting abilities in solution.

ElectronsElectronPhotochemistryHydrocarbons AromaticCatalysisGas phaseCatalysischemistry.chemical_compoundBiomimeticsMaterials ChemistryOrganic chemistryElectrodeschemistry.chemical_classificationPyrenesMetals and AlloysQuinonesOxidation reductionGeneral ChemistryElectron acceptorBenzoquinoneSurfaces Coatings and FilmsElectronic Optical and Magnetic MaterialschemistryCeramics and CompositesPyreneOxidation-ReductionCatalytic method
researchProduct