Search results for "Benzonitrile"

showing 10 items of 65 documents

Do fluorescence and transient absorption probe the same intramolecular charge transfer state of 4-(dimethylamino)benzonitrile?

2009

International audience; We present here the results of time-resolved absorption and emission experiments for 4-(dimethylamino)benzonitrile in solution, which suggest that the fluorescent intramolecular charge transfer (ICT) state may differ from the twisted ICT (TICT) state observed in transient absorption.

Time Factorstime resolved spectraGeneral Physics and Astronomyvisible spectra010402 general chemistryPhotochemistry01 natural sciencesTime resolved spectraSpectral lineFluorescencechemistry.chemical_compoundspectrochemical analysisOrganic compoundsUltrafast laser spectroscopyNitrilesCharge exchangePhysical and Theoretical ChemistryVisible spectra:FÍSICA::Química física [UNESCO]Fluorescent DyesSpectrochemical analysis010405 organic chemistryChemistrycharge exchangeFluorescenceUNESCO::FÍSICA::Química física0104 chemical sciences3. Good health[CHIM.THEO]Chemical Sciences/Theoretical and/or physical chemistryBenzonitrileIntramolecular forceCharge exchange ; Fluorescence ; Organic compounds ; Spectrochemical analysis ; Time resolved spectra ; Visible spectraAbsorption (chemistry)Time-resolved spectroscopyLuminescenceorganic compoundsThe Journal of chemical physics
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Electrochemistry of Bis(pyridine)cobalt (Nitrophenyl)corroles in Nonaqueous Media

2018

International audience; A series of bis(pyridine)cobalt corroles with one or three nitrophenyl groups on the meso positions of the corrole macrocycle were synthesized and characterized as to their electrochemical and spectroscopic properties in dichloromethane, benzonitrile, and pyridine. The potentials for each electrode reaction were measured by cyclic voltammetry and the electron-transfer mechanisms evaluated by analysis of the electrochemical data combined with UV-visible spectra of the neutral, electroreduced, and electroxidized forms of the corroles. The proposed electronic configurations of the initial compounds and the prevailing redox reactions involving the electroactive central c…

[SPI.OTHER]Engineering Sciences [physics]/Otherelectronic-structuremanganese corroleschemistry.chemical_element[CHIM.INOR]Chemical Sciences/Inorganic chemistryConjugated system010402 general chemistryElectrochemistry01 natural sciencesInorganic Chemistryporphyrin-corrole dyadschemistry.chemical_compoundcopper corroleswater-oxidationPyridinePolymer chemistryacid-media[CHIM]Chemical Sciencesaryl-substituted corrolesredox potentialsPhysical and Theoretical ChemistryCorrole010405 organic chemistry0104 chemical sciencesSolventBenzonitrilechemistrystructural-characterizationefficient synthesisCyclic voltammetryCobaltInorganic Chemistry
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CCDC 1042611: Experimental Crystal Structure Determination

2015

Related Article: Tania Romero-Morcillo, Noelia De la Pinta, Lorena M. Callejo, Lucía Piñeiro-López, M. Carmen Muñoz, Gotzon Madariaga, Sacramento Ferrer, Tomasz Breczewski, Roberto Cortés, José A. Real|2015|Chem.-Eur.J.|21|12112|doi:10.1002/chem.201500310

catena-[bis(mu-44'-ethene-12-diyldipyridine)-diisothiocyanato-iron benzonitrile solvate]Space GroupCrystallographyCrystal SystemCrystal StructureCell ParametersExperimental 3D Coordinates
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Switchable Spin-Crossover Hofmann-Type 3D Coordination Polymers Based on Tri- and Tetratopic Ligands

2018

[EN] Fe-II spin-crossover (SCO) coordination polymers of the Hofmann type have become an archetypal class of responsive materials. Almost invariably, the construction of their architectures has been based on the use of monotopic and linear ditopic pyridine like ligands. In the search for new Hofmann-type architectures with SCO properties, here we analyze the possibilities of bridging ligands with higher connectivity degree. More precisely, the synthesis and structure of {Fe-II(L-N3)[M-I(CN)(2)](2)}center dot(Guest) (Guest = nitro-benzene, benzonitrile, o-dichlorobenzene; M-I = Ag, Au) and {Fe-II(L-N4)[Ag-2(CN)(3)][Ag(CN)(2)]}center dot H2O are described, where L-N3 and L-N4 are the tritopic…

chemistry.chemical_classification010405 organic chemistryPolymerType (model theory)010402 general chemistry01 natural sciences0104 chemical sciencesInorganic ChemistryNitrobenzenechemistry.chemical_compoundBenzonitrileCrystallographychemistrySpin crossoverFISICA APLICADAPhysical and Theoretical ChemistryBenzene
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An analysis of the regioselectivity of 1,3-dipolar cycloaddition reactions of benzonitrile n-oxides based on global and local electrophilicity and nu…

2009

The regioselectivity of the 1,3-dipolar cycloaddition (13DC) reactions of benzonitrile N-oxides (BNOs) with electrophilic and nucleophilic alkenes has been analyzed by using global and local nucleophilicity and electrophilicity reactivity indices defined within the conceptual DFT. The BNOs react with electron-deficient and electron-rich ethylenes, but the regioselectivities of these polar reactions are different. Whereas the reactions with electron-rich ethylenes are completely regioselective, yielding 5-isoxazolines, a change in the regioselectivity is observed in the reactions with electron-deficient ethylenes, which yield a mixture of 4- and 5-isoxazolines. Analysis of the energies, geom…

chemistry.chemical_classificationAlkeneOrganic ChemistryRegioselectivityPhotochemistryCycloadditionBenzonitrilechemistry.chemical_compoundchemistryNucleophileComputational chemistryElectrophile13-Dipolar cycloadditionReactivity (chemistry)Physical and Theoretical Chemistry
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On the Unique Reactivity of Pd(OAc)2with Organic Azides: Expedient Synthesis of Nitriles and Imines

2013

Organic azides are well-established as versatile compounds that can act as precursors of different heterocycles (triazoles, triazolines, tetrazoles, etc.) or other nitrogen-containing compounds, such as amines (Staudinger reduction, Curtius rearrangement) or imines (Schmidt rearrangement, aza-Wittig reaction).1 Besides the ubiquitous copper-catalysed azide–alkyne cycloaddition reaction,2 two applications of organic azides have recently attracted the interest of the synthetic community: 1) the preparation of aziridines through the generation of nitrenes3 and 2) the synthesis of nitriles. We were particularly interested in the latter application, owing to the importance of the cyano group in …

chemistry.chemical_classificationNitrileChemistryOrganic ChemistryImineAlkyneCyanationCatalysisCycloadditionInorganic Chemistrychemistry.chemical_compoundBenzonitrileOrganic chemistryOrganic synthesisAzidePhysical and Theoretical ChemistryChemCatChem
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Über umsetzungen an poly-p-lithiumstyrol. 4. Mitt. Darstellung carbonylgruppenhaltiger derivate des polystyrols

1961

In Fortsetzung fruherer Arbeiten wird die Reaktivitat von Poly-p-lithiumstyrol gegenuber solchen Agenzien gepruft, die zur Bildung von carbonylgruppenhaltigen Verbindungen fuhren. Wahrend bei der Umsetzung mit Orthoameisensaureester nur vernetzte Polymere entstechen, last sich mit Dimethylformamid ein losliches Derivat des Polystyrols herstellen das p-standige Formylgruppen tragt. Die Reaktion mit Nitrilen liefert polymere Ketone; mit Acetophenon entsteht Poly-p-vinylacetophenon, das mit dem aus dem Monomeren durch Polymerisation erhaltenen Produkt verglichen wird. Mit Benzonitril erhalt man Poly-p-vinylbenzophenon. Die polymeren Ketone konnen in die Oxime ubergefuhrt werden, deren Sticksto…

chemistry.chemical_classificationchemistry.chemical_compoundBenzonitrileMonomerKetonechemistryPolymer chemistryBenzophenoneDimethylformamideReactivity (chemistry)OximeAcetophenoneDie Makromolekulare Chemie
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An MEDT study of the mechanism and selectivities of the [3+2] cycloaddition reaction of tomentosin with benzonitrile oxide

2019

chemistry.chemical_compoundBenzonitrileMaterials sciencechemistryOxidePhysical and Theoretical ChemistryCondensed Matter PhysicsPhotochemistryTomentosinAtomic and Molecular Physics and OpticsCycloadditionMechanism (sociology)International Journal of Quantum Chemistry
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Electrochemistry, spectroelectrochemistry and catalytic activity of biscobalt bisporphyrin dyads towards dioxygen reduction

2011

Three face-to-face biscobalt bisporphyrin dyads, including one incorporating a copper(II) ion inside the linker, were synthesized and characterized both spectroscopically and electrochemically in three non-aqueous solvents, dichloromethane, benzonitrile and pyridine. The electrocatalytic reduction of dioxygen with these derivatives on an electrode surface in 1.0 M HClO4 was also investigated and the results are compared to that obtained with "regular" Pacman biscobalt bisporphyrins under the same experimental conditions. Surprisingly, the tris-metal species ( Cu-bisCo ) catalyzes the reduction of O2 mainly via a 2e- transfer process, leading to H2O2 , while the bis-metal (bisCo) catalyst p…

chemistry.chemical_compoundBenzonitrilechemistryPyridineElectrodechemistry.chemical_elementGeneral ChemistryElectrochemistryPhotochemistryLinkerCopperCatalysisDichloromethaneJournal of Porphyrins and Phthalocyanines
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Understanding the kinetic solvent effects on the 1,3-dipolar cycloaddition of benzonitrile N-oxide: a DFT study

2011

JOURNAL OF PHYSICAL ORGANIC CHEMISTRY, ISSN : 0894-3230, DOI : 10.1002/poc.1858, Issue : 7, Volume : 24, pp. 611 – 618, JUILLET 2011.

chemistry.chemical_compoundBenzonitrilechemistryVolume (thermodynamics)Computational chemistryOrganic Chemistry13-Dipolar cycloadditionPhysical organic chemistryOxideDensity functional theoryPhysical and Theoretical ChemistrySolvent effectsElectron localization functionJournal of Physical Organic Chemistry
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