Search results for "ELECTRON-TRANSFER"

showing 5 items of 15 documents

Triggering the generation of an iron(IV)-oxo compound and its reactivity toward sulfides by RuII photocatalysis

2014

The preparation of [FeIV(O)(MePy2tacn)]2+ (2, MePy2tacn = N-methyl-N,N-bis(2-picolyl)-1,4,7-triazacyclononane) by reaction of [FeII(MePy2tacn)(solvent)]2+ (1) and PhIO in CH3CN and its full characterization are described. This compound can also be prepared photochemically from its iron(II) precursor by irradiation at 447 nm in the presence of catalytic amounts of [Ru II(bpy)3]2+ as photosensitizer and a sacrificial electron acceptor (Na2S2O8). Remarkably, the rate of the reaction of the photochemically prepared compound 2 toward sulfides increases 150-fold under irradiation, and 2 is partially regenerated after the sulfide has been consumed; hence, the process can be repeated several times.…

SulfideFotocatàlisi010402 general chemistryPhotochemistry01 natural sciencesBiochemistryChemical reactionArticleCatalysisCatalysisReaccions químiquesReaction rateColloid and Surface ChemistrySofre -- CompostosChemical reactionsSulphur compoundsOrganic chemistryWATER[CHIM.COOR]Chemical Sciences/Coordination chemistryPhotosensitizerReactivity (chemistry)Photocatalysischemistry.chemical_classificationOXYGENATION REACTIONS010405 organic chemistryChemistryGeneral ChemistryElectron acceptorSTATE0104 chemical sciencesELECTRON-TRANSFER PROPERTIESC-H OXIDATIONSPIN FE(IV) COMPLEXPhotocatalysisIRON-OXO COMPLEXESLIGANDTAURINE/ALPHA-KETOGLUTARATE DIOXYGENASENONHEME OXOIRON(IV) COMPLEXES
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DFT study on the cycloreversion of thietane radical cations.

2011

The molecular mechanism of the cycloreversion (CR) of thietane radical cations has been analyzed in detail at the UB3LYP/6-31G* level of theory. Results have shown that the process takes place via a stepwise mechanism leading to alkenes and thiobenzophenone; alternatively, formal [4 + 2] cycloadducts are obtained. Thus, the CR of radical cations 1a, b(center dot+) is initiated by C2-C3 bond breaking, giving common intermediates INa,b. At this stage, two reaction pathways are feasible involving ion molecule complexes IMCa,b (i) or radical cations 4a,b(center dot+) (ii). Calculations support that 1a(center dot+) follows reaction pathway (leading to the formal [4 + 2] cycloadducts 5a). By cont…

ThietaneSTEADY-STATEFree RadicalsStereoisomerismOXETANEOxetanePhotochemistryPolarizable continuum modelPHOTOINDUCED-ELECTRON-TRANSFERPhotoinduced electron transferchemistry.chemical_compoundQUIMICA ORGANICACICLOREVESIONCationsMolecule(THIA)PYRYLIUM SALTSSulfhydryl CompoundsPhysical and Theoretical ChemistryDNA PHOTOLYASEDFT CALCULATIONREPAIRMolecular StructureTHIETANECLEAVAGEOtras Ciencias QuímicasCiencias QuímicasStereoisomerismRADICAL CATIONchemistryRadical ionEXCITED-STATESPOLARIZABLE CONTINUUM MODELCyclizationDENSITYQuantum TheoryThiobenzophenoneCIENCIAS NATURALES Y EXACTASThe journal of physical chemistry. A
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Metal Dependence on the Bidirectionality and Reversibility of the Singlet Energy Transfer in Artificial Special Pair-Containing Dyads

2017

International audience; The demetalation of a precursor dyad, 3, built upon a zinc(II)-containing artificial special pair and free-base antenna, leads to a new dyad, 4, for singlet energy transfer composed of cofacial free-base porphyrins (acceptor), [Fb](2) bridged by a 1,4-C6H4 group to a free-base antenna (donor), [Fb]. This dyad exhibits the general structure [M](2)-C6H4-[Fb], where [M](2) = [Fh](2), and completes a series reported earlier, where [M](2) = [Mg](2) (2) and [Zn](2) (3). The latter dyads exhibit a bidirectional energy-transfer process at 298 K for 2 and at 77 K for 3. Interestingly, a very scarce case of cycling process is observed for the zinc-containing dyad at 298 K. The…

cofacial bisporphyrin dyadsStereochemistryEnergy transferchemistry.chemical_elementZinc[CHIM.INOR]Chemical Sciences/Inorganic chemistry010402 general chemistry01 natural sciencesphotoinduced electron-transferInorganic ChemistryMetalmolecular-orbital methodsMolecular orbitalSinglet statePhysical and Theoretical Chemistryphotosynthetic reaction-centerdensity-functional theoryvalence basis-setsbase hybrid diporphyrins010405 organic chemistry[ CHIM.INOR ] Chemical Sciences/Inorganic chemistryResonance (chemistry)Acceptor0104 chemical sciencesCrystallographychemistrylight-harvesting systemsvisual_artpolarizable continuum modelvisual_art.visual_art_mediumDensity functional theoryextended basis-sets
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On the synthesis of functionalized porphyrins and porphyrin conjugates via β-aminoporphyrins

2016

International audience; The synthesis of functionalized porphyrins and their conjugates from meso-tetraarylporphyrins through the acylation and the oxidation of beta-aminoporphyrins was investigated. 2,3-Dioxochlorins were prepared by the oxidation of a variety of beta-aminoporphyrins and subsequently used in a condensation reaction with functionalized aromatic aldehydes and ammonium acetate to form beta-functionalized porphyrins bearing a fused imidazole ring. Under optimized experimental conditions both reactions tolerate various functional groups and afford the products in an appropriate overall yield. The mildness and usefulness of this methodology are illustrated by several examples in…

coordination010402 general chemistryRing (chemistry)01 natural sciences[ CHIM ] Chemical SciencesCatalysisphotoinduced electron-transferAcylationchemistry.chemical_compoundMaterials Chemistrypolycyclic compoundsImidazoleOrganic chemistry[CHIM]Chemical Sciencesalpha-dionesbuilding-blockspyrrolic position010405 organic chemistrysensitized solar-cellsbodipy dyesGeneral Chemistryefficient peripheral functionalizationCondensation reactionCombinatorial chemistryPorphyrin0104 chemical scienceswater-solubilizationchemistryYield (chemistry)systemsAmmonium acetateConjugate
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Synthesis, Electrochemistry, and Photophysics of Aza-BODIPY Porphyrin Dyes

2016

International audience; The synthesis of dyad and triad aza-BODIPY-porphyrin systems in two steps starting from an aryl-substituted aza-BODIPY chromophore is described. The properties of the resulting aza-BODIPY-porphyrin conjugates have been extensively investigated by means of electrochemistry, spectroelectrochemistry, and absorption/emission spectroscopy. Fluorescence measurements have revealed a dramatic loss of luminescence intensity, mainly due to competitive energy transfer and photoinduced electron transfer involving charge separation followed by recombination.

resonance energy-transferporphyrinoidstetraarylazadipyrromethenes010402 general chemistryPhotochemistryElectrochemistry01 natural sciences7. Clean energy[ CHIM ] Chemical SciencesCatalysisFluorescence spectroscopyPhotoinduced electron transfersinglet oxygentransfersphotoinduced electron-transferphotoinduced electron transferchemistry.chemical_compoundgeneration[CHIM]Chemical Scienceselectrogenerated chemiluminescencespectroscopic propertiespolyadsAbsorption (electromagnetic radiation)aza-BODIPYs010405 organic chemistryfullereneOrganic ChemistryGeneral ChemistryChromophorefluorescence spectroscopyPorphyrinFluorescence0104 chemical sciences3. Good healthchemistryelectrochemistryderivativesLuminescence
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