Search results for "Lysis"

showing 10 items of 34769 documents

Unveiling the Occurrence of Co(III) in NiCo Layered Electroactive Hydroxides: The Role of Distorted Environments

2020

Co- and Ni-based layered hydroxides constitute a unique class of two-dimensional inorganic materials with exceptional chemical diversity, physicochemical properties and outstanding performance as supercapacitors and overall water splitting catalysts. Recently, the occurrence of Co(III) in these phases has been proposed as a key factor that enhance their electrochemical performance. However, the origin of this centers and control over its contents remains as an open question. We employed the Epoxide Route to synthesize a whole set of α-NiCo layered hydroxides. The PXRD and XAS characterization alert about the occurrence of Co(III) as a consequence of the increment in the Ni content. DFT+U si…

010402 general chemistryElectrochemistry01 natural sciencesRedoxCatalysisCatalysis//purl.org/becyt/ford/1 [https]symbols.namesake//purl.org/becyt/ford/1.4 [https]LAYERED HYDROXIDESX-ray absorption spectroscopy2D MATERIALS010405 organic chemistryChemistryOrganic ChemistryFermi levelGeneral Chemistry0104 chemical sciencesCharacterization (materials science)Chemical engineeringOctahedronWATER SPLITTINGsymbolsWater splittingENERGY STORAGESUPERCAPACITANCEChemistry – A European Journal
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Phosphasalen group IV metal complexes: synthesis, characterization and ring opening polymerization of lactide.

2020

International audience; We report the synthesis of a series of Zr and Ti complexes bearing phosphasalen which differs from salen by the incorporation of two P atoms in the ligand backbone. The reaction of phosphasalen proligands (1a-1c)H2 with Zr(CH2Ph)4 led to different products depending on the nature of the N,N-linker in the ligand. In case of ethylene-linked phosphasalen, octahedral Zr complex 2a formed as a single stereoisomer in trans geometry. With the phenylene linker, it was shown by dynamic NMR spectroscopy that complex 2b exists as a mixture of trans and cis-β isomers in solution, both enantiomers (Δ and Λ) of the cis-β isomer being in fast equilibrium with respect to the NMR tim…

010402 general chemistryLIGANDS SYNTHESIS01 natural sciencesRing-opening polymerizationCoordination complexInorganic ChemistryINDIUM COMPLEXESOctahedral molecular geometry[CHIM]Chemical SciencesSALALEN COMPLEXESCYCLIC ESTERSCOORDINATION CHEMISTRYZIRCONIUM COMPLEXES; COORDINATION CHEMISTRY; SALALEN COMPLEXES; LIGANDS SYNTHESIS; INDIUM COMPLEXES; SALEN LIGANDS; CYCLIC ESTERS; INITIATORS; CATALYSIS; ALUMINUMchemistry.chemical_classification010405 organic chemistryLigandCATALYSISCationic polymerizationNuclear magnetic resonance spectroscopyALUMINUM0104 chemical sciencesCrystallographychemistrySALEN LIGANDSAlkoxy groupINITIATORS[CHIM.OTHE]Chemical Sciences/OtherIsomerizationZIRCONIUM COMPLEXESDalton transactions (Cambridge, England : 2003)
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The first example of cofacial bis(dipyrrins)

2016

International audience; Two series of cofacial bis(dipyrrins) were prepared and their photophysical properties as well as their bimolecular fluorescence quenching with C-60 were investigated. DFT and TDDFT computations were also performed as a modeling tool to address the nature of the fluorescence state and the possible inter-chromophore interactions. Clearly, there is no evidence for such interactions and the bimolecular quenching of fluorescence, in comparison with mono-dipyrrins, indicates that C-60-bis(dipyrrin) contacts occur from the outside of the "mouth" of the cofacial structure.

010402 general chemistryPhotochemistry01 natural sciences[ CHIM ] Chemical SciencesCatalysisTransition metalexcitation-energiesmolecular-orbital methodsorganometallic compoundsMaterials Chemistry[CHIM]Chemical Sciencessinglet energy transfersdensity-functional theoryvalence basis-setsGroup 2 organometallic chemistryQuenching (fluorescence)010405 organic chemistryChemistryGeneral ChemistryTime-dependent density functional theorytransition-metalsFluorescence0104 chemical scienceslight-harvesting systems2nd-row elementsDensity functional theoryextended basis-sets
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Heavy enzymes and the rational redesign of protein catalysts

2019

Abstract An unsolved mystery in biology concerns the link between enzyme catalysis and protein motions. Comparison between isotopically labelled “heavy” dihydrofolate reductases and their natural‐abundance counterparts has suggested that the coupling of protein motions to the chemistry of the catalysed reaction is minimised in the case of hydride transfer. In alcohol dehydrogenases, unnatural, bulky substrates that induce additional electrostatic rearrangements of the active site enhance coupled motions. This finding could provide a new route to engineering enzymes with altered substrate specificity, because amino acid residues responsible for dynamic coupling with a given substrate present…

010402 general chemistryProtein Engineering01 natural sciencesBiochemistryCatalysisEnzyme catalysisisotope effectsCatalytic DomainDihydrofolate reductaseMolecular BiologyAlcohol dehydrogenasechemistry.chemical_classificationalcohol dehydrogenasesCarbon Isotopesdihydrofolate reductasesbiologyBacteriaNitrogen Isotopes010405 organic chemistryConceptOrganic ChemistryAlcohol DehydrogenaseActive siteSubstrate (chemistry)Protein engineeringDeuteriumCombinatorial chemistrymolecular dynamics0104 chemical sciencesKineticsTetrahydrofolate Dehydrogenaseenzyme engineeringEnzymechemistrybiology.proteinBiocatalysisMolecular MedicineConcepts
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9,10-Phenanthrenedione as Visible-Light Photoredox Catalyst: A Green Methodology for the Functionalization of 3,4-Dihydro-1,4-Benzoxazin-2- Ones thro…

2018

A visible-light photoredox functionalization of 3,4-dihydro-1,4-benzoxazin-2-ones through a Friedel-Crafts reaction with indoles using an inexpensive organophotoredox catalyst is described. The reaction uses a dual catalytic system that is formed by a photocatalyst simple and cheap, 9,10-phenanthrenedione, and a Lewis acid, Zn(OTf)2. 5W white LEDs are used as visible-light source and oxygen from air as a terminal oxidant, obtaining the corresponding products with good yields. The reaction can be extended to other electron-rich arenes. Our methodology represents one of the most valuable and sustainable approach for the functionalization of 3,4-dihydro-1,4-benzoxazin-2-ones, as compared to th…

010402 general chemistrylcsh:Chemical technology01 natural sciencesCatalysisCatalysislcsh:Chemistrychemistry.chemical_compoundCatàlisiTryptophollcsh:TP1-1185Lewis acids and basesorganic_chemistryPhysical and Theoretical ChemistryFriedel-Crafts reactionFriedel–Crafts reaction010405 organic chemistryindolesCombinatorial chemistry0104 chemical scienceschemistrylcsh:QD1-999visible-light photocatalysis14-benzoxazin-2-onesPhotocatalysisSurface modificationorganophotoredox catalysisQuímica orgànicaDerivative (chemistry)Visible spectrum
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A concise route to MK-4482 (EIDD-2801) from cytidine.

2020

A two-step route to MK-4482 (EIDD-2801, 1) was developed consisting of an esterification and hydroxamination of cytidine. The selective acylation and direct amination eliminate the need for protecting and activating groups and proceed in overall yield of 75%, a significant advancement over the reported yield of 17%. The step count is reduced from five transformations to two, and expensive uridine is replaced with the more available cytidine.

010405 organic chemistryAcylationMetals and AlloysCytidineGeneral ChemistryCytidine010402 general chemistryHydroxylamines01 natural sciencesCombinatorial chemistryCatalysisUridine0104 chemical sciencesSurfaces Coatings and FilmsElectronic Optical and Magnetic MaterialsAcylationchemistry.chemical_compoundKineticschemistryYield (chemistry)Materials ChemistryCeramics and CompositesStep countAminationChemical communications (Cambridge, England)
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Unsymmetrical Iron P-NH-P' Catalysts for the Asymmetric Pressure Hydrogenation of Aryl Ketones.

2017

R.H.M. thanks NSERC Canada for a Discovery grant and the Canada Council for the Arts for a Killam Fellowship. This work was also made possible by the SCICOMP NMR facilities provided by the Canada Foundation for Innovation, project number 19119, and the Ontario Ministry of Research, Innovation and Science. The Deutscher Akademischer Austauschdienst (DAAD) is thanked for support for A.P. Calculations were performed using the facilities of SHARCNET and Scinet of Compute/Calcul Canada

010405 organic chemistryArylOrganic ChemistryNoyori asymmetric hydrogenationGeneral Chemistry010402 general chemistry01 natural sciencesCatalysis0104 chemical sciencesCatalysischemistry.chemical_compoundchemistryOrganic chemistryChristian ministryChemistry (Weinheim an der Bergstrasse, Germany)
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Gold(II) Porphyrins in Photoinduced Electron Transfer Reactions

2019

Chemistry - a European journal 25(23), 5940 - 5949 (2019). doi:10.1002/chem.201900050

010405 organic chemistryArylOrganic ChemistryPhotoredox catalysisGeneral Chemistry010402 general chemistryPhotochemistry54001 natural sciencesRedoxPorphyrinCatalysisPhotoinduced electron transfer0104 chemical scienceslaw.inventionchemistry.chemical_compoundElectron transferchemistrylawddc:540AzideElectron paramagnetic resonance
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First copper(I) ferrocenyltetraphosphine complexes: possible involvement in Sonogashira cross-coupling reaction ?

2008

Preparation and characterization of the first examples of copper(I) ferrocenylpolyphosphine complexes are reported. The molecular structure of complex {P,P′,P′′-[1,1′,2,2′-tetrakis(diphenylphosphino)-4,4′-di-tert-butylferrocene]iodocopper(I)} (1) was solved by X-ray diffraction studies, and its fluxional behavior in solution was investigated by VT-31P NMR; both revealed a net triligated coordination preference of the ferrocenyl tetraphosphine Fc(P)4tBu with copper. The tetradentate ligand is an active auxiliary in Sonogashira alkynylation; therefore the general question of copper as a competitive coordination partner in the Pd/Cu-catalyzed Sonogashira reaction was raised and discussed. Elec…

010405 organic chemistryArylOrganic Chemistry[ CHIM.COOR ] Chemical Sciences/Coordination chemistrySonogashira couplingchemistry.chemical_element010402 general chemistry01 natural sciencesMedicinal chemistryCopperCoupling reaction0104 chemical sciencesCatalysisInorganic Chemistrychemistry.chemical_compoundchemistryPhenylacetyleneMolecule[CHIM.COOR]Chemical Sciences/Coordination chemistryPhysical and Theoretical ChemistryComputingMilieux_MISCELLANEOUSPalladium
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The European Young Chemists Award 2016

2016

The future is in good hands! The European Young Chemist Award for 2016 was awarded at the 6th EuCheMS Chemistry Congress in Seville. Reflections on the participants and their chemistry from the Convener of the event, Professor Bruno Pignataro, are given in the Guest Editorial.

010405 organic chemistryChemistry (all)Organic ChemistryGeneral Chemistry010402 general chemistry01 natural sciencesCatalysis0104 chemical sciencesChemistry - A European Journal
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