Search results for "molecular conformation"

showing 10 items of 376 documents

Diversity-Oriented Synthesis of Polycyclic Scaffolds by Modification of an Anodic Product Derived from 2,4-Dimethylphenol

2010

Molecular ConformationStereoisomerismGeneral ChemistryXylenesCrystallography X-RayElectrochemistryCatalysischemistry.chemical_compoundchemistryProduct (mathematics)Organic chemistryPolycyclic CompoundsPhenolsElectrodesOxidation-ReductionAngewandte Chemie International Edition
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Enantioselective zinc-mediated conjugate alkynylation of saccharin-derived 1-aza-butadienes

2020

The enantioselective 1,4-alkynylation of conjugated imines derived from saccharin with aryl- and alkyl-substituted terminal alkynes has been achieved. The reaction mediated by diethylzinc in the presence of a catalytic amount of a bis(hydroxy)malonamide chiral ligand provides the corresponding imines bearing a propargylic stereocenter with moderate yields and fair to excellent enantioselectivities.

Molecular Conformationchemistry.chemical_elementZincConjugated systemCrystallography X-RayLigandsCatalysisStereocenterchemistry.chemical_compoundSaccharinCompostos orgànicsMaterials ChemistryChemistryArylChiral ligandMetals and AlloysEnantioselective synthesisStereoisomerismGeneral ChemistryDiethylzincCombinatorial chemistrySurfaces Coatings and FilmsElectronic Optical and Magnetic MaterialsZincCeramics and CompositesIminesQuímica orgànicaConjugateChemical Communications
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Influence of chirality on the structure of phospholipid monolayers.

1993

Molecular StructureChemistryStereochemistryPhosphatidylethanolaminesSynthetic membranePhospholipidBiophysicsMolecular ConformationStereoisomerismMembranes ArtificialStereoisomerismCrystal structureMolecular conformationBiophysical Phenomenachemistry.chemical_compoundX-Ray DiffractionMonolayerBiophysicsMoleculeChirality (chemistry)PhospholipidsResearch ArticleBiophysical journal
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Unusual conformations of 1,3-dialkoxythiacalix[4]arenes in the solid state

2006

The structures of three syn-1,3-dialkoxythiacalix[4]arenes with unusual conformations in the solid state are reported. The pinched cone conformation of syn-2 2 ,4 2 -dihydroxy-1 2 ,3 2 -bis-(prop-2-enyloxy)thiacalix[4]arene, C 30 H 24 O 4 S 4 , (3a), is stabilized by two intramolecular hydrogen bonds, remarkably formed from both OH groups to the same ether O atom. In syn-22,42-dihydroxy-1 5 ,2 5 ,3 5 ,4 5 -tetranitro-12,32-bis(prop-2-enyloxy)thiacalix[4]arene acetone disolvate, C 30 H 20 N 4 O 12 S 4 ·-2C 3 H 6 O, (3b1), the molecule is found in the 1,3-alternate conformation. The crystallographic C2 symmetry is due to a twofold rotation axis running through the centre of the calixarene rin…

Molecular StructureSulfur CompoundsStereochemistryHydrogen bondMolecular ConformationHydrogen BondingEtherGeneral MedicineCrystal structureCrystallography X-RayAcceptorGeneral Biochemistry Genetics and Molecular BiologySolventCrystallographychemistry.chemical_compoundchemistryIntramolecular forceCalixareneMoleculeCalixarenesEthersActa Crystallographica Section C Crystal Structure Communications
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Stereoselective Synthesis and Cytoselective Toxicity of Monoterpene-Fused 2-Imino-1,3-thiazines

2014

Starting from pinane-, apopinane- and carane-based 1,3-amino alcohols obtained from monoterpene-based β-amino acids, a library of monoterpene-fused 2-imino-1,3-thiazines as main products and 2-thioxo-1,3-oxazines as side-products were prepared via two- or three-step syntheses. When thiourea adducts prepared from 1,3-amino alcohols and aryl isothiocyanates were reacted with CDI under mild conditions, O-imidazolylcarbonyl intermediates were isolated which could be transformed to the desired 1,3-thiazines under microwave conditions. 1,3-Thiazines and 2-thioxo-1,3-oxazine side-products could also be prepared in one-step reactions through the application of CDI and microwave irradiation. The rin…

MonoterpeneMolecular ConformationThiazinesPharmaceutical ScienceStereoisomerismArticleAnalytical ChemistryAdductHeLalcsh:QD241-441chemistry.chemical_compoundlcsh:Organic chemistryantiproliferativeCell Line TumorDrug DiscoveryOrganic chemistryHumansPhysical and Theoretical Chemistryta116Cell ProliferationbiologystereoselectiveArylOrganic Chemistry13-thiazineStereoisomerismbiology.organism_classificationCycloalkanechemistryThiourea13-amino alcoholChemistry (miscellaneous)MonoterpenesMolecular MedicineStereoselectivityCDImonoterpeneMolecules
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New potent antibacterials against Gram-positive multiresistant pathogens: effects of side chain modification and chirality in linezolid-like 1,2,4-ox…

2014

The effects of side chain modification and chirality in linezolid-like 1,2,4-oxadiazoles have been studied to design new potent antibacterials against Gram-positive multidrug-resistant pathogens. The adopted strategy involved a molecular modelling approach, the synthesis and biological evaluation of new designed compounds, enantiomers separation and absolute configuration assignment. Experimental determination of the antibacterial activity of the designed (S)-1-((3-(4-(3-methyl-1,2,4-oxadiazol-5- yl)phenyl)-oxazolidin-2-one-5-yl)methyl)-3-methylthiourea and (S)-1-((3-(3-fluoro-4-(3-methyl-1,2,4- oxadiazol-5-yl)phenyl)-oxazolidin-2-one-5-yl)methyl)-3-methylthiourea against multidrug resistan…

Multidrug-resistant bacteriaClinical BiochemistryAntibioticsDrug ResistanceMolecular ConformationPharmaceutical ScienceBiochemistrychemistry.chemical_compoundAntibioticsDrug Resistance Multiple BacterialDrug DiscoveryAcetamidesSide chainOxadiazolesAbsolute configurationBacterialStereoisomerismHep G2 CellsBIO/10 - BIOCHIMICA23SAnti-Bacterial AgentsMolecular Docking SimulationRNA Ribosomal 23SDrug design Linezolid Antibiotics Multidrug-resistant bacteria EnantiomersMolecular MedicineAntibacterial activityMultipleMethicillin-Resistant Staphylococcus aureusStaphylococcus aureusmedicine.drug_classStereochemistryCell SurvivalMicrobial Sensitivity TestsGram-Positive BacteriaDrug designmedicineHumansMolecular BiologyOxazolidinonesRibosomalBinding SitesOrganic ChemistryAntibioticLinezolidSettore CHIM/06 - Chimica OrganicaSettore CHIM/08 - Chimica FarmaceuticaMultiple drug resistancechemistryEnantiomersMED/07 - MICROBIOLOGIA E MICROBIOLOGIA CLINICALinezolidRNANucleic Acid ConformationEnantiomerChirality (chemistry)Bioorganicmedicinal chemistry
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Negative differential resistance in carbon nanotube field-effect transistors with patterned gate oxide.

2010

We demonstrate controllable and gate-tunable negative differential resistance in carbon nanotube field-effect transistors, at room temperature and at 4.2 K. This is achieved by effectively creating quantum dots along the carbon nanotube channel by patterning the underlying, high-kappa gate oxide. The negative differential resistance feature can be modulated by both the gate and the drain-source voltage, which leads to more than 20% change of the current peak-to-valley ratio. Our approach is fully scalable and opens up a possibility for a new class of nanoscale electronic devices using negative differential resistance in their operation.

NanostructureMaterials scienceTransistors ElectronicMacromolecular SubstancesSurface PropertiesMolecular ConformationGeneral Physics and AstronomyNanotechnologyCarbon nanotubelaw.inventionComputer Science::Emerging TechnologiesGate oxidelawMaterials TestingElectric ImpedanceNanotechnologyGeneral Materials ScienceParticle SizeTransistorGeneral EngineeringOxidesEquipment DesignCondensed Matter::Mesoscopic Systems and Quantum Hall EffectNanostructuresEquipment Failure AnalysisHysteresisQuantum dotField-effect transistorCrystallizationVoltageACS nano
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Surfactant-Dependent Exciton Mobility in Single-Walled Carbon Nanotubes Studied by Single-Molecule Reactions

2010

Measurements of stepwise photoluminescence quenching in individual, (n,m)-selected single-walled carbon nanotubes (SWCNTs) undergoing chemical reaction have been analyzed to deduce mobilities of optically generated excitons. For (7,5) nanotubes, the mean exciton range varies between approximately 140 and 240 nm for different surfactant coatings and correlates weakly with nanotube PL intensity. The results are consistent with a model of localized SWCNT excitons having substantial diffusional mobility along the nanotube axis.

NanotubeMaterials scienceLightSurface PropertiesExcitonMolecular ConformationSelective chemistry of single-walled nanotubesMolecular Probe TechniquesBioengineeringNanotechnologyCarbon nanotubeChemical reactionlaw.inventionSurface-Active AgentsCondensed Matter::Materials SciencePulmonary surfactantlawMaterials TestingNanotechnologyScattering RadiationMoleculeGeneral Materials ScienceParticle SizeNanotubes CarbonCondensed Matter::OtherMechanical EngineeringGeneral ChemistryCondensed Matter::Mesoscopic Systems and Quantum Hall EffectCondensed Matter PhysicsOptical properties of carbon nanotubesChemical physicsLuminescent MeasurementsCrystallizationNano Letters
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Hierarchical Assembly of TiO2 Nanoparticles on WS2 Nanotubes Achieved Through Multifunctional Polymeric Ligands

2007

Thefunctionalization of nanotubes is required in order to bene-fit from their outstanding properties, as any application inmaterials and devices is hindered by processing and manipu-lation difficulties. Only the attachment of appropriate chem-ical functionalities on the nanotube surface allows tailoringof the properties for the respective applications. As an ex-ample, the enhancement of the nanotube solubility is onemajor task since most pristine nanotubes are insoluble inboth water and organic solvents. Thus, the improvement ofthe solubility by chemical functionalization is an importantconcept for synthetic chemists and materials scientists. Tai-loring of the surface chemical bonds might a…

NanotubeMaterials scienceMacromolecular SubstancesPolymersSurface PropertiesMolecular ConformationSelective chemistry of single-walled nanotubesNanoparticleNanotechnologyLigandsBiomaterialsMaterials TestingNanotechnologyGeneral Materials ScienceParticle SizeSolubilityTitaniumchemistry.chemical_classificationSulfur CompoundsBiomoleculeGeneral ChemistryPolymerTungsten CompoundsNanostructureschemistryNanoelectronicsSurface modificationCrystallizationBiotechnologySmall
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In situ nucleation of carbon nanotubes by the injection of carbon atoms into metal particles.

2007

The synthesis of carbon nanotubes (CNTs) of desired chiralities and diameters is one of the most important challenges in nanotube science and achieving such selectivity may require a detailed understanding of their growth mechanism. We report the formation of CNTs in an entirely condensed phase process that allows us, for the first time, to monitor the nucleation of a nanotube on the spherical surface of a metal particle. When multiwalled CNTs containing metal particle cores are irradiated with an electron beam, carbon from graphitic shells surrounding the metal particles is ingested into the body of the particle and subsequently emerges as single-walled nanotubes (SWNTs) or multiwalled nan…

NanotubeMaterials scienceMacromolecular SubstancesSurface PropertiesBiomedical EngineeringSelective chemistry of single-walled nanotubesNucleationMolecular Conformationchemistry.chemical_elementBioengineeringNanotechnologyMechanical properties of carbon nanotubesCarbon nanotubelaw.inventionCondensed Matter::Materials SciencelawMaterials TestingNanotechnologyGeneral Materials ScienceElectrical and Electronic EngineeringParticle SizeNanotubes CarbonCondensed Matter::Mesoscopic Systems and Quantum Hall EffectCondensed Matter PhysicsAtomic and Molecular Physics and OpticsCarbonOptical properties of carbon nanotubeschemistryChemical engineeringMetalsParticleCrystallizationCarbonNature nanotechnology
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