Search results for "405"

showing 10 items of 3208 documents

Synthesis, characterization and magnetic study of two new octahedral iron(III) complexes with pendant zwitterionic Schiff bases

2016

Two Schiff bases, HL1 [2-((3-(dimethylamino)propylimino)methyl)-5-bromophenol] and HL2 [2-((2-(diethylamino)ethylimino)methyl)-6-methoxyphenol], have been employed to prepare two new octahedral iron(III) complexes, [Fe(HL1)2(N3)2]ClO4·2H2O (1) and [Fe(HL2)2(NCS)2]ClO4·H2O (2). Both complexes are characterized by spectral and elemental analyses. Single crystal X-ray diffraction studies confirm their structures. In both complexes, Schiff bases are trapped in their zwitterionic forms and coordinated to iron(III) only through the imine nitrogen and phenoxo oxygen, i.e., they behave as bi-dentate ligands, keeping the remaining potential donor sites pendant. The measurement of χM vs. T for both c…

crystal structurevariable temperature magnetic susceptibilityIminechemistry.chemical_elementCrystal structure010402 general chemistry01 natural sciencesOxygenzwiterionicInorganic Chemistrypendantchemistry.chemical_compoundMaterials ChemistryOrganic chemistryPhysical and Theoretical ChemistryMagnetic studyta116010405 organic chemistryNitrogen0104 chemical sciencesCrystallographychemistryOctahedronPotential donorSingle crystaliron(III)Inorganica Chimica Acta
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Spontaneous Resolution of an Electron‐Deficient Tetrahedral Fe4L4cage

2015

A highly electron-deficient C3-symmetric tris(bipyridyl) ligand was prepared in four steps and used for the coordination of Fe(OTf)2, thereby resulting in the homochiral assembly of a new family of robust tetrahedral M4L4 cages. This homochiral T-symmetric cage containing a relatively large cavity of 330 A(3) is capable of encapsulating an anionic guest, as was determined by mass spectrometry, (19)F NMR spectroscopy, and finally shown from its crystal structure. Moreover, crystallization of the cage from CH3CN led to crystals containing both (ΔΔΔΔ and ΛΛΛΛ) enantiomers, while crystallization from CH3 OH resulted in crystals containing only the right-handed (ΔΔΔΔ) cage. The difference in the…

crystallization010405 organic chemistryChemistryLigandelectron-deficient tetrahedral Fe4L4Supramolecular chemistryGeneral ChemistryNuclear magnetic resonance spectroscopyCrystal structureGeneral Medicine010402 general chemistry01 natural sciencesCatalysis0104 chemical scienceslaw.inventionCrystalCrystallographylawX-ray crystallographyCrystallizationChirality (chemistry)ta116Angewandte Chemie
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Mono‐ and Bis(imidazolidinium ethynyl) Cations and Reduction of the Latter To Give an Extended Bis‐1,4‐([3]Cumulene)‐p-carboquinoid System

2017

An extended π-system containing two [3]cumulene fragments separated by a p-carboquinoid and stabilized by two capping N-heterocyclic carbenes (NHCs) has been prepared. Mono- and bis(imidazolidinium ethynyl) cations have also been synthesized from the reaction of an NHC with phenylethynyl bromide or 1,4-bis(bromoethynyl)benzene. Cyclic voltammetry coupled with synthetic and structural studies showed that the dication is readily reduced to a neutral, singlet bis-1,4-([3]cumulene)-p-carboquinoid as a result of the π-accepting properties of the capping NHCs. peerReviewed

cumulenes010405 organic chemistryreductionGeneral MedicineN-heterocyclic carbenes010402 general chemistryalkynes01 natural sciencespropargyl cations0104 chemical sciences3. Good health
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A new member of the fusaricidin family – structure elucidation and synthesis of fusaricidin E

2017

Two hitherto unknown fusaricidins were obtained from fermentation broths of three Paenibacillus strains. After structure elucidation based on tandem mass spectrometry and NMR spectroscopy, fusaricidin E was synthesized to confirm the structure and the suggested stereochemistry. The synthesis was based on a new strategy which includes an efficient access to the 15-guanidino-3-hydroxypentadecanoyl (GHPD) side chain from erucamide.

cyclodepsipeptidesStereochemistry010402 general chemistryTandem mass spectrometry01 natural sciencesFull Research Paperlcsh:QD241-441Paenibacilluslcsh:Organic chemistrySide chaintotal synthesislcsh:Sciencebiology010405 organic chemistryChemistryFamily structureOrganic Chemistrystructure elucidationTotal synthesisNuclear magnetic resonance spectroscopyfusaricidinsbiology.organism_classificationlipopeptides0104 chemical sciencesChemistryFermentationlcsh:QBeilstein Journal of Organic Chemistry
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An easy access to fused chromanones via rhodium catalyzed oxidative coupling of salicylaldehydes with heterobicyclic olefins

2016

Abstract Herein we describe a detailed study on the rhodium catalyzed oxidative coupling of salicylaldehydes with heterobicyclic olefins such as diazabicyclic olefins and urea-derived bicyclic olefins. The developed method provides an ideal route to fused chromanone systems in a single synthetic step. Moreover, the scope of this methodology was extended to different oxa/aza-bridged bicyclic urea derivatives.

diazabicyclic olefinsBicyclic moleculechromanone010405 organic chemistryOrganic Chemistrychemistry.chemical_elementrhodium catalyzedsalicylaldehyde010402 general chemistry01 natural sciencesBiochemistry0104 chemical sciencesRhodiumCatalysischemistry.chemical_compoundchemistrySalicylaldehydeDrug DiscoveryOrganic chemistryOxidative coupling of methaneUrea derivativesta116urea derived bicyclic olefinsTetrahedron
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Efficient photoinduced electron transfer in a porphyrin tripod-fullerene supramolecular complex via pi-pi interactions in nonpolar media.

2010

A novel porphyrin tripod (TPZn(3)) was synthesized via "click chemistry". Three porphyrin moieties of TPZn(3) are geometrically close and linked by a flexible linker. The electron-transfer oxidation of TPZn(3) results in intramolecular pi-dimer formation between porphyrin moieties as indicated by electrochemical, vis-NIR, and ESR measurements. The cyclic voltammogram of TPZn(3) exhibited stepwise one-electron oxidation processes of three porphyrin moieties in the range from 0.58 to 0.73 V (vs SCE in CH(2)Cl(2)). When TPZn(3) was oxidized by tris(2,2'-bipyridyl)-ruthenium(III) ([Ru(bpy)(3)](3+)), the oxidized species (TPZn(3))(n+) (0n/= 3) exhibited a charge resonance band in the NIR region …

dyadFullerenePorphyrinsMacromolecular SubstancesPhotochemistrySupramolecular chemistrycharge-separated state010402 general chemistryPhotochemistry01 natural sciencesBiochemistryCatalysisPhotoinduced electron transferchemistry.chemical_compoundColloid and Surface Chemistry[ CHIM.ORGA ] Chemical Sciences/Organic chemistryMoleculeComputingMilieux_MISCELLANEOUSMolecular Structure[CHIM.ORGA]Chemical Sciences/Organic chemistry010405 organic chemistryTripod (photography)reaction center mimicryGeneral ChemistryPorphyrin0104 chemical sciences[CHIM.THEO]Chemical Sciences/Theoretical and/or physical chemistryZincchemistryIntramolecular forceclick chemistry[ CHIM.THEO ] Chemical Sciences/Theoretical and/or physical chemistryClick chemistryQuantum TheoryFullerenesporphyrinOxidation-ReductionJournal of the American Chemical Society
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Special Issue: Improvements for Resveratrol Efficacy

2017

International audience; Resveratrol is a well-known phenolic stilbene because of its presence in several edible plants and its proposed properties that are beneficial to human health [...].

educationPharmaceutical Sciencemacromolecular substancesResveratrol010402 general chemistry01 natural sciences[ CHIM ] Chemical SciencesAnalytical Chemistrylcsh:QD241-441Human healthchemistry.chemical_compoundlcsh:Organic chemistryStilbenesDrug DiscoveryHumansMedicine[CHIM]Chemical SciencesPhysical and Theoretical ChemistryCyclodextrins010405 organic chemistrybusiness.industryOrganic Chemistryfood and beverages3. Good health0104 chemical sciencesBiotechnologyEditorialn/achemistryResveratrolChemistry (miscellaneous)LiposomesEdible plantsMolecular MedicinebusinessMolecules
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Structural, thermal and photomagnetic properties of spin crossover [Fe(bpp)2]2+ salts bearing [Cr(L)(ox)2]- anions

2009

International audience; This paper is divided into two parts: in the first part, the influence of solvate molecules on the magnetic properties of spin crossover salts of [Fe(bpp)(2)][Cr(L)(ox)(2)]ClO(4) x nS (bpp = 2,6-bis(pyrazol-3yl)pyridine; L = 2,2'-bipyridine (bpy) or 1,10-phenanthroline (phen); ox = oxalate dianion; S = solvent) is analyzed. The second part is devoted to the photomagnetic properties of the previously reported [Fe(bpp)(2)][Cr(L)(ox)(2)](2) family of compounds. The study describes the crystal structure, differential scanning calorimetry (DSC) and magnetic properties of [Fe(bpp)(2)][Cr(bpy)(ox)(2)]ClO(4) x EtOH x 4 H(2)O (1) and [Fe(bpp)(2)][Cr(phen)(ox)(2)]ClO(4) x 1.5 …

education.field_of_study010405 organic chemistryChemistryPopulationCrystal structure[CHIM.MATE]Chemical Sciences/Material chemistry010402 general chemistry01 natural sciencesLIESSTOxalate0104 chemical sciencesInorganic ChemistryCrystallographychemistry.chemical_compoundNuclear magnetic resonanceDifferential scanning calorimetrySpin crossoverPyridineMoleculeeducation
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Substituent effects of nitro group in cyclic compounds

2020

AbstractNumerous studies on nitro group properties are associated with its high electron-withdrawing ability, by means of both resonance and inductive effect. The substituent effect of the nitro group may be well described using either traditional substituent constants or characteristics based on quantum chemistry, i.e., cSAR, SESE, and pEDA/sEDA models. Interestingly, the cSAR descriptor allows to describe the electron-attracting properties of the nitro group regardless of the position and the type of system. Analysis of classical and reverse substituent effects of the nitro group in various systems indicates strong pi-electron interactions with electron-donating substituents due to the re…

education.field_of_study010405 organic chemistryPopulationSubstituentMolecular modeling010402 general chemistryCondensed Matter PhysicsRing (chemistry)Resonance (chemistry)01 natural sciencesMedicinal chemistryQuantum chemistry0104 chemical sciencesNitro groupchemistry.chemical_compoundDelocalized electronCharge of the substituent active regionchemistrySigma and pi electron structureSubstituent effectsNitroSubstituent effect stabilization energyPhysical and Theoretical ChemistryeducationInductive effectStructural Chemistry
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Syntheses of Trifluoroethylated N-Heterocycles from Vinyl Azides and Togni’s Reagent Involving 1,n-Hydrogen-Atom Transfer Reactions

2020

2,2,2-Trifluoroethyl-substituted 3-oxazolines, 3-thiazolines, and 5,6-dihydro-2H-1,3-oxazines have been obtained by reacting substituted vinyl azides with a combination of Togni’s reagent and substoichiometric amounts of iron(II) chloride. The results of density functional theory calculations support the proposed mechanism involving 1,n-hydrogen-atom transfer reactions. peerReviewed

eetteritenergia010405 organic chemistryChemistryOrganic ChemistryreagentsHydrogen atom010402 general chemistry01 natural sciencesBiochemistryChloride0104 chemical sciencesetherssubstituentsReagentredox reactionsPolymer chemistryreagenssitmedicineDensity functional theoryPhysical and Theoretical Chemistryenergymedicine.drugOrganic Letters
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