Search results for " hydrogen"

showing 10 items of 319 documents

Hydrogen bond-stabilised N-alkylammonium resorcinarene halide cavitands

2010

A family of hydrogen bond-stabilised N-alkylammonium resorcinarene chloride and bromide cavitands were synthesised and characterised with 1H NMR and ESI mass spectrometry. The seven compounds exhibit interestingly either self-inclusion or guest complexation in the solid state evidenced by single crystal X-ray diffraction. The four dimers show self-inclusion of the upper rim propyl chains and consist of two hydrogen-bonded resorcinarene tetracations and six halide anions, while the remaining two halide anions are located in between the dimers linking them via hydrogen bonding. Small solvent molecules such as dichloromethane, methanol, n-butanol or chloroform are complexed into the resorcinar…

ChloroformHydrogen bondHalideGeneral ChemistryResorcinarenePhotochemistrySolventchemistry.chemical_compoundchemistryBromidePolymer chemistryProton NMRMoleculeresorcinarenes; tetrabenzoxazines; ammonium halides; hydrogen bonding; X-ray structure
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Measurement of the Md3+/Md2+ Reduction Potential Studied with Flow Electrolytic Chromatography

2013

The reduction behavior of mendelevium (Md) was studied using a flow electrolytic chromatography apparatus. By application of the appropriate potentials on the chromatography column, the more stable Md(3+) is reduced to Md(2+). The reduction potential of the Md(3+) + e(-) → Md(2+) couple was determined to be -0.16 ± 0.05 V versus a normal hydrogen electrode.

ChromatographyStandard hydrogen electrodeFlow (psychology)Analytical chemistrychemistry.chemical_elementElectrolyteIonMendeleviumInorganic ChemistryReduction (complexity)chemistryPhysical and Theoretical ChemistryLuminescenceChromatography columnInorganic Chemistry
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Optimizing Renewable Power Management in Transmission Congestion. An Energy Hub Model Using Hydrogen Storage

2021

Energy production from distributed renewable power plants underwent a takeoff in last years as never before. Nevertheless, the installation of technologies based on variable energy resources and their connection on transmission power lines might cause congestions due to the transmission capacity limits. This paper describes the modelization of a HV transmission line with local renewable production and its optimal management through an Energy Hub model. Aim of the study is to identify the optimal size of the power storage, based on an electoryzer, a hydrogen storage and a fuel cell, in order to minimize the congestion risks and to maximize the exploitation of renewable energy production.

Computer sciencebusiness.industryElectrolyzer energy hub green hydrogen optimization wind turbineAutomotive engineeringRenewable energySettore ING-IND/33 - Sistemi Elettrici Per L'EnergiaHydrogen storageElectric power transmissionTransmission (telecommunications)Transmission lineProduction (economics)TakeoffbusinessEnergy (signal processing)2021 IEEE International Conference on Environment and Electrical Engineering and 2021 IEEE Industrial and Commercial Power Systems Europe (EEEIC / I&CPS Europe)
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A mathematical description accounting for the superfluous hydrogen evolution and the inductive behaviour observed during electrochemical measurements…

2018

When electrochemical techniques are used to probe the surface of corroding magnesium with the aim of obtaining quantitative information on the corrosion process, two peculiarities are generally observed: i) with anodic polarization, the rate of hydrogen evolution increases instead of decreasing and ii) during electrochemical impedance spectroscopy measurements, an inductive contribution is often observed at the low-frequency end of the spectra. The presence of these two phenomena clearly has an impact on the methodology that should be applied to correctly estimate corrosion rates from electrochemical data. The aim of this work is to provide a general mathematical description of the corrodin…

CorrosionSettore ING-IND/23 - Chimica Fisica ApplicataInductive behaviourElectrochemistryMagnesiumChemical Engineering (all)Superfluous hydrogen evolution
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Electrocatalytic Behavior of Tetrathiafulvalene (TTF) and Extended Tetrathiafulvalene (exTTF) [FeFe] Hydrogenase Mimics

2021

TTF- and exTTF-containing [(μ-S2)Fe2(CO)6] complexes have been prepared by the photochemical reaction of TTF or exTTF and [(μ-S2)Fe2(CO)6]. These complexes are able to interact with PAHs. In the absence of air and in acid media an electrocatalytic dihydrogen evolution reaction (HER) occurs, similarly to analogous [(μ-S2)Fe2(CO)6] complexes. However, in the presence of air, the TTF and exTTF organic moieties strongly influence the electrochemistry of these systems. The reported data may be valuable in the design of [FeFe] hydrogenase mimics able to combine the HER properties of the [FeFe] cores with the unique TTF properties

Cultural StudiesHistoryHydrogenaseLiterature and Literary TheoryChemistryFerredoxin HydrogenaseDithiol-Iron(III)-Sulphide ComplexOrganic chemistryQuímicaCombinatorial chemistrychemistry.chemical_compoundQD241-441ComplexTetrathiafulvaleneInorganic chemistryQD146-197ACS Organic & Inorganic Au
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Solubility and solvation features of native cyclodextrins in 1-ethyl-3-methylimidazolium acetate

2022

The comprehension of the mechanism entailing efficient solvation of cyclodextrins (CD) by green solvents is of great relevance to boost environmentally sustainable usages of smart supramolecular systems. Here, 1-ethyl-3- methylimidazolium acetate, an ecofriendly ionic liquid (IL), is considered as an excellent solvent for native CDs. This IL efficiently dissolves up to 40 wt.% β- and γ-CD already at ambient temperature and X-ray scattering indicates that CDs do not tend to detrimental flocculation under these drastic concentration conditions. Simu- lation techniques reveal the intimate mechanism of CD solvation by the ionic species: while the strong hydrogen bonding acceptor acetate anion i…

CyclodextrinsPolymers and Plasticscyclodextringreen chemistrysolubilityOrganic ChemistryIonic liquids Solvation Hydrophobic solvation Cyclodextrin Emerging task specific solvents Sustainability Molecular dynamics Hydrogen bondingMaterials ChemistryImidazolesSolventsiONIC lIQUIDS cyclodextrin solubility green chemistryiONIC lIQUIDSSettore CHIM/02 - Chimica Fisica
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Changes in membrane lipid composition in ethanol- and acid-adapted Oenococcus oeni cells: characterization of the cfa gene by heterologous complement…

2008

International audience; Cyclopropane fatty acid (CFA) synthesis was investigated in Oenococcus oeni. The data obtained demonstrated that acid-grown cells or cells harvested in the stationary growth phase showed changes in fatty acid composition similar to those of ethanol-grown cells. An increase of the CFA content and a decrease of the oleic acid content were observed. The biosynthesis of CFAs from unsaturated fatty acid phospholipids is catalysed by CFA synthases. Quantitative real-time-PCR experiments were performed on the cfa gene of O. oeni, which encodes a putative CFA synthase. The level of cfa transcripts increased when cells were harvested in stationary phase and when cells were gr…

CyclopropanesMESH: Hydrogen-Ion ConcentrationTranscription GeneticMESH: Gram-Positive Coccimedicine.disease_causechemistry.chemical_compoundMESH: CyclopropanesCloning MolecularMESH: Bacterial ProteinsOenococcus oeni0303 health sciencesMESH: Gene Expression Regulation BacterialMESH: Genetic Complementation TestbiologyStrain (chemistry)MESH: Escherichia coliFatty AcidsHydrogen-Ion ConcentrationMESH: Fatty AcidsGram-Positive CocciComplementationRNA BacterialBiochemistryMESH: RNA BacterialMESH: EthanolMESH: Sequence AlignmentMicrobiologycomplex mixturesMembrane Lipids03 medical and health sciencesBacterial ProteinsMESH: MethyltransferasesEscherichia colimedicineMESH: Cloning Molecular[SDV.BBM]Life Sciences [q-bio]/Biochemistry Molecular BiologyCyclopropane fatty acidEthanol metabolismEscherichia coliUnsaturated fatty acid030304 developmental biologyEthanol030306 microbiologyMESH: Transcription GeneticGenetic Complementation TestMESH: Oleic AcidGene Expression Regulation BacterialMethyltransferasesbiology.organism_classificationOleic acidchemistryMESH: Membrane LipidsSequence AlignmentOleic Acid
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Intracellular pH-dependent efflux of the fluorescent probe pyranine in the yeast Yarrowia lipolytica.

2001

International audience; 8-Hydroxypyrene-1,3,6-trisulfonic acid (pyranine) can be used as a vital intracellular pH (pH(i)) indicator. In the yeast Yarrowia lipolytica, a partial efflux of the probe was detected by using the pH-independent wavelength of 415 nm. A simplified correction of the fluorescent signals was applied, enabling to show for this species a good near-neutral pH(i) maintenance capacity in a pH 3.9 medium. Octanoic acid, which is known to have toxic effects on yeast, decreased the pH(i) and increased the 260-nm-absorbing compounds leakage. However, this acid inhibited the fluorescent probe efflux linearly with its concentration suggesting a pH(i)-dependent efflux of pyranine …

CytoplasmMESH: Hydrogen-Ion ConcentrationCell Membrane Permeability[SDV.BIO]Life Sciences [q-bio]/BiotechnologyOctanoic Acidschemistry.chemical_compoundMESH : Fluorescent DyesMESH: Cell Membrane PermeabilityArylsulfonates[INFO.INFO-BT]Computer Science [cs]/BiotechnologyMESH: ArylsulfonatesMESH : Octanoic AcidsbiologyCaprylic acidHydrogen-Ion ConcentrationMESH: Fluorescent DyesFluorescenceBiochemistryEffluxCaprylates[ INFO.INFO-BT ] Computer Science [cs]/BiotechnologyIntracellularMESH : CytoplasmIntracellular pHMESH: Biological Transport[SDV.BC]Life Sciences [q-bio]/Cellular BiologyMicrobiologyPyranineMESH : ArylsulfonatesMESH : Hydrogen-Ion ConcentrationGeneticsMESH: SaccharomycetalesMolecular Biology[SDV.BC] Life Sciences [q-bio]/Cellular BiologyFluorescent Dyes[ SDV.BC ] Life Sciences [q-bio]/Cellular BiologyMESH: Cytoplasm[ SDV.BIO ] Life Sciences [q-bio]/BiotechnologyYarrowiaBiological TransportMESH : Saccharomycetalesbiology.organism_classificationMESH: Octanoic AcidsYeast[SDV.BIO] Life Sciences [q-bio]/BiotechnologyMESH : Biological Transport[INFO.INFO-BT] Computer Science [cs]/BiotechnologychemistryMESH : Cell Membrane PermeabilitySaccharomycetales
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Conformational analysis of α,β-dehydropeptide models at the HF and DFT levels

2004

Abstract The Ramachandran potential energy surfaces of N-acetyl-α,β-dehydroamino acid N′-monomethylamides Ac-ΔXaa-NHMe (ΔXaa=ΔAla, (Z)-ΔPhe; 1, 2) and N-acetyl-α,β-dehydroamino acid N′,N′-dimethylamides Ac-ΔXaa-NMe2 (ΔXaa=ΔAla, (Z)-ΔPhe, (Z)-ΔAbu; 3–5) were calculated at the HF/6-31G*//HF/3-21G level. The conformers localised were fully optimised at the DFT/B3LYP/6-31+G** level and their relative stabilities were analysed in terms of both π-conjugation and internal hydrogen bonding. The Ac-ΔXaa-NMe2 molecules reveal the low-energy conformer H/F, φ=−41±4°, ψ=128±4°, which is not too easily accessible for common amino acid residues. This conformer is stabilised by the bifurcated N2–CH3 O1 int…

DehydrophenylalanineHydrogen bondStereochemistryIntermolecular forceIntramolecular hydrogen bondingPotential energy surfaceCondensed Matter PhysicsDehydroalanineBiochemistryPotential energyDimethylamideschemistry.chemical_compoundchemistryDehydroalaninePotential energy surfaceMoleculePhysical and Theoretical ChemistryConformational isomerismRamachandran plotJournal of Molecular Structure: THEOCHEM
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Oleochemical carbonates: A comprehensive characterization of an emerging class of organic compounds

2022

Dialkyl carbonates (DAC) with short-medium alkyl length - oleochemical carbonates – are attracting attention because of their appealing properties, including low viscosity, flammability, toxicity, environ- mental impact and wide range of applications: lubricants, personal care, fuel additives etc. However, not much is known concerning their chemical physical properties and, more importantly, on the nature of microscopic correlations that eventually determine bulk performances. In view of this paucity, we pre- sent a large exploration of a series of chemical physical properties of a set of DACs ranging from dimethyl up to didodecyl carbonate. This study extends previously determined database…

Dialkyl carbonate Sustainable Mesoscopic organization Hydrogen bonding Molecular Dynamics X-ray ScatteringMaterials ChemistryPhysical and Theoretical ChemistryCondensed Matter PhysicsSpectroscopyAtomic and Molecular Physics and OpticsElectronic Optical and Magnetic MaterialsSettore CHIM/02 - Chimica Fisica
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