Search results for "40"

showing 10 items of 17345 documents

Photo-Chromium: Sensitizer for Visible-Light-Induced Oxidative C−H Bond Functionalization-Electron or Energy Transfer?

2017

The chromium(III) sensitizer [Cr(ddpd)2]3+ - based on an earth-abundant metal center - possesses a unique excited state potential energy landscape (ddpd = N,N'-dimethyl-N,N'-dipyridine-2-ylpyridine-2,6-diamine). The very large energy gap between the redox active and substitutionally labile 4T2 state and the long-lived low-energy 2E spin-flip state enables a selective, efficient sensitization of triplet dioxygen to give singlet dioxygen. Ultrafast intersystem crossing after the Franck Condon point from the 4T2 to the 2E excited state within 3.5 ps precludes intermolecular electron transfer pathways from the ultrashort-lived excited 4T2 state. This specific excited state reactivity enables a …

010405 organic chemistrySinglet oxygenOrganic ChemistryIntermolecular forcechemistry.chemical_element010402 general chemistryPhotochemistry01 natural sciences0104 chemical sciencesAnalytical Chemistrychemistry.chemical_compoundChromiumElectron transferIntersystem crossingchemistryExcited stateSinglet fissionReactivity (chemistry)Physical and Theoretical ChemistryChemPhotoChem
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Room-Temperature Phosphorescence and Efficient Singlet Oxygen Production by Cyclometalated Pt(II) Complexes with Aromatic Alkynyl Ligands

2020

The synthesis of five novel cyclometalated platinum(II) compounds containing five different alkynyl-chromophores was achieved by the reaction of the previously synthesized Pt–Cl cyclometalated compound (1) with the corresponding RC≡CH by a Sonogashira reaction. It was observed that the spectral and photophysical characteristics of the cyclometalated platinum(II) complexes (Pt–Ar) are essentially associated with the platinum-cyclometalated unit. Room-temperature emission of the Pt–Ar complexes was attributed to phosphorescence in agreement with DFT calculations. Broad nanosecond (ns)-transient absorption spectra were observed with decays approximately identical to those obtained from the emi…

010405 organic chemistrySinglet oxygenPhosphorescenceluminesenssichemistry.chemical_elementkompleksiyhdisteetorganometalliyhdisteetOxigen010402 general chemistryLigands01 natural sciencesCombinatorial chemistry0104 chemical sciencesInorganic ChemistryOxygenchemistry.chemical_compoundhappiLligandschemistryFosforescènciaPhysical and Theoretical ChemistryPhysics::Chemical PhysicsPhosphorescencePlatinum
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Co–Co and Co–Fe cyano-bridged pentanuclear clusters based on a methylpyrazinyl-diamine tetradentate ligand: spin crossover and metal substitution eff…

2017

A pentanuclear [CoII3CoIII2] cluster complex has been developed by a solvothermal synthesis. Its highly stable metal-mixed Fe–Co derivatives display robust spin crossover (T1/2 = 268 K) controlled by the degree of substitution.

010405 organic chemistrySolvothermal synthesisSubstitution (logic)General Chemistry010402 general chemistryCondensed Matter PhysicsPhotochemistry01 natural sciences0104 chemical sciencesMetalCrystallographychemistry.chemical_compoundDegree of substitutionchemistrySpin crossovervisual_artDiaminevisual_art.visual_art_mediumCluster (physics)General Materials ScienceTetradentate ligandCrystEngComm
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Three Co(II) Metal-Organic Frameworks with Diverse Architectures for Selective Gas Sorption and Magnetic Studies.

2019

Three Co(II) metal–organic frameworks, namely, {[Co2(L)2(OBA)2(H2O)4]·xG}n (1), {[Co(L)0.5(OBA)]·xG}n (2), and {[Co2(L)2(OBA)2(H2O)]·DMA·xG}n (3) [where L = 2,5-bis(3-pyridyl)-3,4-diaza-2,4-hexadiene, H2OBA = 4,4′-oxybisbenzoic acid, DMF = dimethylformamide, DMA = dimethylacetamide, and G denotes disordered guest molecules], have been synthesized under diverse reaction conditions through self-assembly of a bent dicarboxylate and a linear spacer with a Co(II) ion. While 1 is crystallized at room temperature in DMF to form a 2D layer structure, 2 is formed by the assembly of similar components under solvothermal conditions with a 3D network structure. On the other hand, changing the solvent t…

010405 organic chemistrySorptionMicroporous material010402 general chemistry01 natural sciencesDimethylacetamide0104 chemical sciencesInorganic ChemistrySolventchemistry.chemical_compoundCrystallographychemistryDimethylformamideMoleculeMetal-organic frameworkPhysical and Theoretical ChemistryBET theoryInorganic chemistry
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Magneto-structural correlations in a family of ReIVCuII chains based on the hexachlororhenate(IV) metalloligand

2017

Six novel one-dimensional chloro-bridged ReIVCuII complexes of formula {[Cu(L)4][ReCl6]}n, where L = imidazole (Imi, 1), 1-methylimidazole (Meim, 2), 1-vinylimidazole (Vim, 3), 1-butylimidazole (Buim, 4), 1-vinyl-1,2,4-triazole (Vtri, 5) and N,N’-dimethylformamide (DMF, 6) are characterised structurally, magnetically and theoretically. The structures exhibit significant differences in Cu–Cl bond lengths and Re–Cl–Cu bridging angles, resulting in large differences in the nature and magnitude of magnetic exchange interactions between the ReIV and CuII ions. Theoretical calculations reveal the coupling to be primarily ferromagnetic, increasing in magnitude as the bridging angle becomes smaller…

010405 organic chemistryStereochemistry010402 general chemistry01 natural sciences0104 chemical sciencesMagnetic exchangeIonInorganic ChemistryBond lengthchemistry.chemical_compoundCrystallographychemistryFerromagnetismImidazole
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Further synthetic and structural investigations of new pre-organized picket porphyrins

2005

The straightforward synthesis of three new picket porphyrins with a restrained conformation is described. These porphyrins have an unusual behavior due to the conjugated but still flexible nature of their pickets. The crystal structure of their common precusor is also reported and confirms the presumed geometry of this type of picket. Indeed, the latter one is formally obtained by the conjugation of two aromatic rings through an amide bond. Although the specific shape of the picket is expected to overcrowd the center of the porphyrin, it is shown that different types of nucleophilic reagents can add easily on these pickets.

010405 organic chemistryStereochemistryAromaticityGeneral ChemistryConjugated system010402 general chemistry01 natural sciencesPorphyrin[ CHIM ] Chemical Sciences0104 chemical scienceschemistry.chemical_compoundCrystallographychemistryNucleophile[CHIM] Chemical SciencesPeptide bond[CHIM]Chemical SciencesPicketingComputingMilieux_MISCELLANEOUS
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Unexpected Scholl Reaction of 6,7,13,14-Tetraarylbenzo[k]tetraphene: Selective Formation of Five-Membered Rings in Polycyclic Aromatic Hydrocarbons

2016

Cyclodehydrogenation is a versatile reaction that has enabled the syntheses of numerous polycyclic aromatic hydrocarbons (PAHs). We now describe a unique Scholl reaction of 6,7,13,14-tetraarylbenzo[k]tetraphene, which "unexpectedly" forms five-membered rings accompanying highly selective 1,2-shift of aryl groups. The geometric and optoelectronic nature of the resulting bistetracene analogue with five-membered rings is comprehensively investigated by single-crystal X-ray, NMR, UV-vis absorption, and cyclic voltammetry analyses. Furthermore, a possible mechanism is proposed to account for the selective five-membered-ring formation with the rearrangement of the aryl groups, which can be ration…

010405 organic chemistryStereochemistryArylGeneral Chemistry010402 general chemistryHighly selective01 natural sciencesBiochemistryCatalysis0104 chemical sciencesScholl reactionchemistry.chemical_compoundColloid and Surface ChemistrychemistryComputational chemistryDensity functional theoryAbsorption (chemistry)Cyclic voltammetryTetrapheneJournal of the American Chemical Society
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Amino‐Substituted Ferra‐bis(tricarbollides) − Metallatricarbaboranes Designed for Linear Molecular Constructions

2004

Reactions between high purity FeCl2 and the anion [nido-7-(tBuHN)-7,8,9-C3B8H10)]− (1−) have been used for efficient syntheses of the twelve-vertex double-cluster metallatricarbollide complexes of the para,para (p,p) type [closo-9,9′(RHN)2-commo-2,2′-FeII-1,7,9-(C3B8H10)-1′,7′,9′-(C3B8H10)] (2) (2a, R = tBu and 2b, R = H) (yields 42−45% for 2a). Compound 2b, which contains two reactive amino substituents conveniently attached to the tricarbollide subclusters in p-positions with respect to the metal center, was prepared via facile cleavage of the tBu substituent in 2a either by AlCl3 or by thermal means. The structure of 2b constitutes a good setting for the synthesis of building blocks for …

010405 organic chemistryStereochemistryCenter (category theory)SubstituentBoranes010402 general chemistryCleavage (embryo)01 natural sciencesMedicinal chemistry0104 chemical sciencesIonInorganic ChemistryMetalchemistry.chemical_compoundchemistryvisual_artReagentvisual_art.visual_art_mediumEuropean Journal of Inorganic Chemistry
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Magnetostructural correlations in CuII−NC−WV linkage: the case of [CuII(diimine)]2+−[WV(CN)8]3− 0D assemblies

2009

International audience; We report on the syntheses, crystal structures, and magnetic properties of two cyano-bridged molecular assemblies: [CuII(phen)3]2{[CuII(phen)2]2[WV(CN)8]2}(ClO4)2·10H2O (phen = 1,10-phenanthroline) (1) and {[CuII(bpy)2]2[WV(CN)8]} {[CuII(bpy)2][WV(CN)8]}·4H2O (bpy = 2,2′-bipyridyl) (2). Compound 1 consists of cyano-bridged [CuII2WV2]2− molecular rectangles and isolated [CuII(phen)3]2+ complexes. The molecular structure of 2 reveals cyano-bridged trinuclear [CuII2WV]+ and dinuclear [CuIIWV]− ions. Magnetic interactions in 1 are interpreted in terms of the model of a tetranuclear moiety consisting of two ferromagnetic CuII−NC−WV units (J1 = +39(4) cm−1) interacting ant…

010405 organic chemistryStereochemistryChemistryCrystal structureCrystal structureMagnetic response[CHIM.MATE]Chemical Sciences/Material chemistry010402 general chemistry01 natural sciencesAntiferromagnetic coupling0104 chemical sciencesIonInorganic ChemistryCrystallographyFerromagnetismTheoryofComputation_ANALYSISOFALGORITHMSANDPROBLEMCOMPLEXITYMagnetic propertiesMoleculeMoietyChemical synthesisPhysical and Theoretical ChemistryCyano bridged molecular assembliesDiimine
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Nature of (C5Me5)2Mo2O5in water–methanol at pH 0–14. On the existence of (C5Me5)MoO2(OH) and (C5Me5)MoO2+: a stopped-flow kinetic analysis

2002

A stopped-flow analysis of compound Cp*2Mo2O5 (Cp* = η5-C5Me5) in 20% MeOH–H2O over the pH range 0–14 has provided the speciation of this molecule as well as the rate and mechanism of interconversion between the various species that are present in solution. The compound is a strong electrolyte in this solvent combination, producing the Cp*MoO2+ and Cp*MoO3− ions in equilibrium with a small amount of Cp*MoO2(OH), the latter attaining ca. 15% relative amount at pH 4. At low pH (  6. The acid dissociation constant of Cp*MoO2(OH) has been measured directly (pK = 3.65 ± 0.02) while the pK for the protonation equilibrium leading to Cp*MoO3H2+ is estimated as  5. The prevalent pathway at high pH i…

010405 organic chemistryStereochemistryChemistryInorganic chemistryKineticsProtonationGeneral Chemistry010402 general chemistry01 natural sciencesCatalysisAcid dissociation constant0104 chemical sciencesCatalysisMetalSolventStrong electrolytevisual_artMaterials Chemistryvisual_art.visual_art_mediumMoleculeNew J. Chem.
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