Search results for "Intermolecular"

showing 10 items of 396 documents

Synthesis and characterization of new 1,4 and 1,5-disubstituted glucopyranosyl 1,2,3-triazole by 1,3-dipolar cycloaddition

2009

Abstract A series of 1,4 and 1,5-disubstituted 1-(β- d -glucopyranosyl)-1,2,3-triazoles has been prepared in an efficient manner with excellent yields using the intermolecular 1,3-dipolar cycloaddition of 1-azido-2,3,4,6-tetra-O-acetyl-β- d -glucopyranose 2 to a variety of substituted alkynes phenylacethylene 3, propargyl alcohol 4, 2-butyn-1,4-diol, 5, 3-propargylbenzimidazole 6 and propargylpyrazole 7 in toluene. The reaction takes place with the formation of both 4- and 5-regioisomers.

123-TriazoleStereochemistryOrganic ChemistryIntermolecular forceCrystal structurePropargyl alcoholTolueneCycloadditionAnalytical ChemistryInorganic Chemistrychemistry.chemical_compoundchemistry13-Dipolar cycloadditionSpectroscopyJournal of Molecular Structure
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Surface charges at the CaF2/water interface allow very fast intermolecular vibrational-energy transfer

2020

Abstract We investigate the dynamics of water in contact with solid calcium fluoride, where at low pH, localized charges can develop upon fluorite dissolution. We use 2D surface‐specific vibrational spectroscopy to quantify the heterogeneity of the interfacial water (D2O) molecules and provide information about the sub‐picosecond vibrational‐energy‐relaxation dynamics at the buried solid/liquid interface. We find that strongly H‐bonded OD groups, with a vibrational frequency below 2500 cm−1, display very rapid spectral diffusion and vibrational relaxation; for weakly H‐bonded OD groups, above 2500 cm−1, the dynamics slows down substantially. Atomistic simulations based on electronic‐structu…

540 Chemistry and allied sciencesMaterials science530 Physics2D sum-frequency generation010402 general chemistry01 natural sciencesCatalysisVibrational energy relaxationSurface chargeDiffusion (business)DissolutionResearch Articlesenergy transfer010405 organic chemistryIntermolecular forceGeneral ChemistryInterfacial Chemistryab-initio molecular dynamics530 Physik0104 chemical sciencesDipoleSolvation shellChemical physicsMolecular vibration540 Chemiesolid/liquid interfacesResearch Article
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Reversible isomerization of metal nanoclusters induced by intermolecular interaction

2021

Most inorganic nanoparticles are directly surface-terminated (and -stabilized) by protecting ligands, which could greatly affect the atomic packing and physical/chemical properties of their inorganic cores. Here, we show that the intermolecular interactions between the adsorbed molecules and surface ligands can also affect the core structure of inorganic nanoparticles. Through the coupling/decoupling of cationic surfactants (cetyltrimethylammonium cations, CTA+) and anionic surface ligands (para-mercaptobenzoic acid, p-MBA) in the aqueous phase, we have achieved a reversible transformation between two isomers of [Au25(p-MBA)18]− nanoclusters. The interconversion process between the two isom…

Absorption spectroscopyLigandChemistryGeneral Chemical EngineeringBiochemistry (medical)Intermolecular forceCationic polymerizationGeneral ChemistryPhotochemistryBiochemistryNanoclustersMetalMolecular dynamicsCrystallographyAdsorptionvisual_artMaterials Chemistryvisual_art.visual_art_mediumEnvironmental ChemistryMoleculeDensity functional theoryIsomerizationChem
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Optical and amplified spontaneous emission of neat films containing 2-cyanoacetic derivatives

2018

During the last two decades, small organic molecules have been widely studied for potential applications in organic solid-state lasers due to low-cost production, simple processing possibility and physical property tuning ability through chemical structure synthetic modifications. One of the most investigated and applied compound in dye lasers is 4- (dicyanomethylene)-2-methyl-6-(4-dimethylaminostyryl)-4H-pyran (DCM). It has shown remarkable properties as a dye in solid-state lasers. One of the drawbacks of this compound is high intermolecular interactions which reduce emission efficiency. Therefore it can be applied only in doped systems in low concentration (around 2 wt%). Recently we hav…

Amplified spontaneous emissionMaterials scienceDye laserPhotoluminescenceDopingIntermolecular forceQuantum yieldMoleculeThin filmPhotochemistryOrganic Electronics and Photonics: Fundamentals and Devices
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Amyloid Fibrils Formation of Concanavalin A at Basic pH

2011

Mechanisms of partial unfolding and aggregation of proteins are of extreme interest in view of the fact that several human pathologies are characterized by the formation and deposition of protein-insoluble material, mainly composed of amyloid fibrils. Here we report on an experimental study on the heat-induced aggregation mechanisms, at basic pH, of concanavalin A (ConA), used as a model system. Thioflavin T (ThT) fluorescence and multiangle light scattering allowed us to detect different intertwined steps in the formation of ConA aggregates. In particular, the ThT fluorescence increase, observed in the first phase of aggregation, reveals the formation of intermolecular β-sheet structure wh…

Amyloid Fibrils Concanavalin A Light scatteringAmyloidLightMultiangle light scatteringFibrilProtein Structure SecondaryLight scatteringchemistry.chemical_compoundPhase (matter)Scattering Small AngleConcanavalin AMaterials ChemistryBenzothiazolesPhysical and Theoretical ChemistrybiologyIntermolecular forceTemperatureHydrogen-Ion ConcentrationFluorescenceSurfaces Coatings and FilmsThiazolesCrystallographySpectrometry FluorescencechemistryConcanavalin ABiophysicsbiology.proteinThioflavinProtein MultimerizationThe Journal of Physical Chemistry B
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Decoding vibrational states of Concanavalin A amyloid fibrils.

2015

International audience; Amyloid and amyloid-like fibrils are a general class of protein aggregates and represent a central topic in life sciences for their involvement in several neurodegenerative disorders and their unique mechanical and supramolecular morphological properties. Both their biological role and their physical properties, including their high mechanical stability and thermodynamic inertia, are related to the structural arrangement of proteins in the aggregates at molecular level. Significant variations may exist in the supramolecular organization of the commonly termed cross-β structure that constitutes the amyloid core. In this context, a fine knowledge of the structural deta…

AmyloidAbsorption spectroscopy[SDV]Life Sciences [q-bio]BiophysicsSupramolecular chemistry02 engineering and technologymacromolecular substancesProtein aggregationAntiparallel (biochemistry)FibrilSpectrum Analysis RamanBiochemistryVibrationProtein Structure Secondary03 medical and health sciencessymbols.namesakeSpectroscopy Fourier Transform InfraredConcanavalin AHumansFourier transform infrared spectroscopyRaman030304 developmental biology0303 health sciencesChemistryOrganic ChemistryIntermolecular force021001 nanoscience & nanotechnologyAmyloid FTIR RAMAN hydration water THz spectroscopy[SDV] Life Sciences [q-bio]CrystallographyFTIRTerahertz spectroscopysymbolsBiophysicsFibrils0210 nano-technologyRaman spectroscopy
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Polysorbate 80 controls Morphology, structure and stability of human insulin Amyloid-Like spherulites

2022

AbstractAmyloid protein aggregates are not only associated with neurodegenerative diseases and may also occur as unwanted by-products in protein-based therapeutics. Surfactants are often employed to stabilize protein formulations and reduce the risk of aggregation. However, surfactants alter protein-protein interactions and may thus modulate the physicochemical characteristics of any aggregates formed. Human insulin aggregation was induced at low pH in the presence of varying concentrations of the surfactant polysorbate 80. Various spectroscopic and imaging methods were used to study the aggregation kinetics, as well as structure and morphology of the formed aggregates. Molecular dynamics s…

Amyloid-like Spherulites Fluorescence Lifetime Imaging Aggregate Stability Polysorbate 80 Protein FormulationsAmyloidMorphology (linguistics)AmyloidChemistryInsulinmedicine.medical_treatmentIntermolecular forcePolysorbatesPolyvinyl alcoholSurfaces Coatings and FilmsElectronic Optical and Magnetic MaterialsBiomaterialsSurface-Active Agentschemistry.chemical_compoundMolecular dynamicsColloid and Surface ChemistryPulmonary surfactantCritical micelle concentrationmedicineBiophysicsHumansInsulinMicelles
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A tailor-made nucleoside-based colourimetric probe of formic acid

2014

A ratiometric, specific probe of formic acid has been developed. It is based on intermolecular nucleobase-pairing of inosine-capped plasmonic nanoparticles to form nucleoside channels, which are destabilised by the analyte.

AnalyteFormatesFormic acidCatalysischemistry.chemical_compoundmental disordersMaterials ChemistryOrganic chemistryRadiometryAcetic AcidPlasmonic nanoparticlesIntermolecular forceMetals and AlloysNucleosidesGeneral ChemistryCombinatorial chemistryGold CompoundsInosineSurfaces Coatings and FilmsElectronic Optical and Magnetic MaterialschemistrySolventsCeramics and CompositesNanoparticlesColorimetryIndicators and ReagentsChloroformNucleosideChem. Commun.
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Bis(5-tert-butyl-2-hydroxy-3-methylbenzyl)(6-hydroxyhexyl)ammonium chloride monohydrate, an anion receptor complex

2007

In the title compound, C(30)H(48)NO(3)(+) x Cl(-) x H(2)O, the cation acts with a water molecule as a chloride ion receptor. The chloride ion forms three strong intramolecular hydrogen bonds. The water molecule forms both an intramolecular bridge between one phenol H atom and the chloride ion, and an intermolecular link to the aliphatic alcohol O atom. Weak intermolecular C-H...Cl and C-H ...O hydrogen bonds provide additional packing interactions.

AnionsModels Molecularinorganic chemicalsBenzylaminesStereochemistryChemistryHydrogen bondIntermolecular forceHydrogen BondingGeneral MedicineCrystallography X-RayChlorideMedicinal chemistryAmmonium ChlorideGeneral Biochemistry Genetics and Molecular BiologyIonchemistry.chemical_compoundIntramolecular forcemedicineMoleculePhenolAmmonium chloridemedicine.drugActa Crystallographica Section C Crystal Structure Communications
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Experimental investigation of anion-π interactions : Applications and biochemical relevance

2015

Chemical communications 52(9), 1778 - 1795(2016). doi:10.1039/C5CC09072E

Anionsanion-pi interactionsSolid-stateChemieNanotechnology010402 general chemistry01 natural sciencesCatalysisIonGas phasekemialliset sidoksetTime frameMaterials Chemistrysupramolekulaarinen kemiaanioni-π-vuorovaikutus010405 organic chemistryChemistryIntermolecular forceMetals and AlloysGeneral Chemistry5400104 chemical sciencesSurfaces Coatings and FilmsElectronic Optical and Magnetic Materialsintermolecular forcesnon-covalent interactionsChemical physicsddc:540Ceramics and Composites
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