Search results for "Azole"

showing 10 items of 2392 documents

Silver(I), Copper(I) and Copper(II) Complex of the New N,Se-Chelate Ligand 2-Phenylselenomethyl-1H-benzimidazole: Electrochemistry and Structure

2009

Abstract. 2-Phenylselenomethyl-1H-benzimidazole (psbi) can form complexes in 2:1 ratio with coinage metal ions. Crystal structure analysis revealed a flattened metal coordination for [AgI(psbi)2](BF4) (1), approaching a distorted planar arrangement with weak Ag-Se bonds (d > 2.9 A) and confirmed as energy minimum by DFT calculations. The typical Jahn-Teller system [CuII(psbi)2Cl2] (2) exhibits a planar CuN2Cl2 core with weak Se---Cu---Se axial ligation (3.2944(8) A Cu--Se distance). The oxygen-sensitive compound [CuI(psbi)2](BF4) (3) exhibits electrochemically reversible oxidation in contrast to the silver(I) analogue 1.

BenzimidazoleLigandMetal ions in aqueous solutionInorganic chemistrychemistry.chemical_elementCrystal structureElectrochemistryCopperInorganic ChemistryMetalchemistry.chemical_compoundCrystallographychemistryvisual_artvisual_art.visual_art_mediumChelationZeitschrift für anorganische und allgemeine Chemie
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Highly Stable and Efficient Light-Emitting Electrochemical Cells Based on Cationic Iridium Complexes Bearing Arylazole Ancillary Ligands.

2017

A series of bis-cyclometalated iridium(III) complexes of general formula [Ir(ppy)2(N∧N)][PF6] (ppy− = 2-phenylpyridinate; N∧N = 2-(1H-imidazol-2-yl)pyridine (1), 2-(2-pyridyl)benzimidazole (2), 1-methyl-2-pyridin-2-yl- 1H-benzimidazole (3), 2-(4′-thiazolyl)benzimidazole (4), 1- methyl-2-(4′-thiazolyl)benzimidazole (5)) is reported, and their use as electroluminescent materials in light-emitting electrochemical cell (LEC) devices is investigated. [2][PF6] and [3][PF6] are orange emitters with intense unstructured emission around 590 nm in acetonitrile solution. [1][PF6], [4][PF6], and [5][PF6] are green weak emitters with structured emission bands peaking around 500 nm. The different photoph…

BenzimidazoleLigandchemistry.chemical_element02 engineering and technologyQuímica analíticaElectroluminescence010402 general chemistry021001 nanoscience & nanotechnologyPhotochemistry01 natural sciences0104 chemical sciencesInorganic Chemistrychemistry.chemical_compoundCrystallographychemistryPyridineIridiumChemistry AnalyticPhysical and Theoretical ChemistryTriplet state0210 nano-technologyAcetonitrileHOMO/LUMOInorganic chemistry
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Heterocyclic photorearrangements. Photochemical behaviour of some 3,5-disubstituted 1,2,4-oxadiazoles in methanol at 254 nm

1988

Photochemical behaviour of some 3,5-disubstituted 1,2,4-oxadiazoles in methanol at 254 nm has been investigated. Ring photoisomerization to the 1,3,4-oxadiazole heterocycle or formation of open chain compounds involving the nucleophilic solvent was shown to depend on the nature and the position of the substituent. Photoinduced ring closure into the benzimidazole system, involving a 3-N-phenylamino side chain sequence and a photolytic intermediate of the oxadiazole heterocycle, is also reported.

Benzimidazolechemistry.chemical_compoundNucleophilePhotoisomerizationchemistryBicyclic moleculeOrganic ChemistrySide chainSubstituentOxadiazoleRing (chemistry)PhotochemistryJournal of Heterocyclic Chemistry
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ChemInform Abstract: Heterocyclic Photorearrangements. Photochemical Behaviour of Some 3,5-Disubstituted 1,2,4-Oxadiazoles in Methanol at 254 nm.

1989

Photochemical behaviour of some 3,5-disubstituted 1,2,4-oxadiazoles in methanol at 254 nm has been investigated. Ring photoisomerization to the 1,3,4-oxadiazole heterocycle or formation of open chain compounds involving the nucleophilic solvent was shown to depend on the nature and the position of the substituent. Photoinduced ring closure into the benzimidazole system, involving a 3-N-phenylamino side chain sequence and a photolytic intermediate of the oxadiazole heterocycle, is also reported.

Benzimidazolechemistry.chemical_compoundPhotoisomerizationNucleophileChemistrySide chainSubstituentOxadiazoleGeneral MedicineMethanolRing (chemistry)PhotochemistryChemInform
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Antiarrhythmika. I. 2,4-dialkylpyrimido[1,2-a]benzimidazole

1981

Aus der Umsetzung von 2-Aminobenzimidazol (1) mit β-Diketonen (2a-d) gehen die 2,4-Dialkylpyrimido[1,2-a]benzimidazole (3a-d) hervor.

Benzimidazolechemistry.chemical_compoundchemistryOrganic ChemistryMedicinal chemistryJournal of Heterocyclic Chemistry
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Synthese und narkotische Wirkung von Pyrimido[1,2-a]benzimidazol-2,4-dionen Synthesis and Anesthetic Activity of Pyrimido[1,2-a]benzimidazole-2,4-dio…

1982

Eine betrachtliche Zahl zentral dampfender Verbindungen weist als gemeinsames Strukturelement die Carbonamidgruppierung in offenkettiger oder cyclischer Form auf. Unsere jungsten Untersuchungen uber antibakteriell1 und herbizid2 wirksame Pyrimido[1,2-a]benzimidazole legten nun nahe, in die Entwicklung dieser Strukturklasse die Carbonamidgruppierung einzubeziehen.

Benzimidazolechemistry.chemical_compoundchemistryStereochemistryDrug DiscoveryAnestheticmedicinePharmaceutical Sciencemedicine.drugArchiv der Pharmazie
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Crystal structure of 5-(5,6-dihydrobenzo[4,5]imidazo[1,2-c]quinazolin-6-yl)-2-methoxyphenol

2015

In the molecule of the title compound, C21H17N3O2, the 5,6-dihydrobenzimidazo[1,2-c]quinazoline moiety is disordered over two orientations about a pseudo-mirror plane, with a refined occupancy ratio of 0.863 (2):0.137 (2). The dihedral angles formed by the benzimidazole ring system and the benzene ring of the quinazoline group are 14.28 (5) and 4.7 (3)° for the major and minor disorder components, respectively. An intramolecular O—H...O hydrogen bond is present. In the crystal, molecules are linked by O—H...N hydrogen bonds, forming chains running parallel to [10-1].

Benzimidazolecrystal structurecyclizationCrystallographyHydrogen bondGeneral ChemistryCrystal structureDihedral angleCondensed Matter PhysicsRing (chemistry)BioinformaticsMedicinal chemistryData Reportschemistry.chemical_compoundchemistryQD901-999QuinazolineMoietyGeneral Materials Scienceimidazole derivativeBenzeneActa Crystallographica Section E: Crystallographic Communications
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Unique Bridging Function of the Triazole Core in Copper(II) Chloride Complexes with 1-Allylbenzotriazole

2005

During alternating-current electrochemical synthesis of copper(I) π-complex of [CuCl{C6H4N3(C3H5)}] composition, starting from ethanol solution, containing CuCl2·2H2O and 1-allylbenzotriazole, green crystals of intermediate [CuII3Cl6{C6H4N3(C3H5)}4] (I) compound has been obtained upon 24 h. After some days these crystals transform into red ones of [CuII2Cl4{C6H4N3(C3H5)}3] (II). Both compounds were X-Ray structurally investigated. Crystals of I are triclinic, sp.gr. a = 9.1329(9), b = 10.0352(4), c = 12.239(3) A, α = 76.443(13), β = 84.470(14), γ = 76.808(7)°, V = 1060.5(3) A3, R = 0.0414 for 3311 reflections. II: monoclinic, C2/c, a = 13.828(1), b = 15.044(2), c = 10.702(1) A, β = 91.36(1)…

Benzotriazole010405 organic chemistryStereochemistryTriazolechemistry.chemical_elementTriclinic crystal system010402 general chemistryElectrochemistry01 natural sciencesCopperNitrogen0104 chemical sciencesInorganic ChemistryCrystallographychemistry.chemical_compoundchemistryCopper(II) chlorideMonoclinic crystal systemZeitschrift f�r anorganische und allgemeine Chemie
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Theoretical absorption and emission spectra of 1H- and 2H-benzotriazole

2003

Excitation energies, dipole moments, and transition properties for the lowest-lying 1(π, π*) and 1(n, π*) electronic states of two benzotriazole tautomers have been studied at the complete active space (CAS) SCF and multiconfigurational second-order perturbation (CASPT2) levels. With these results, the UV absorption spectra of 1H- and 2H-benzotriazole were first described individually, and then they were considered simultaneously in order to better understand the experimental, observed spectrum of benzotriazole. Aspects of the fluorescence of the compound have been also analyzed. The spectrum of benzotriazole is finally related to those of other azo-compounds.

BenzotriazoleAbsorption spectroscopyGeneral Physics and AstronomyPhotochemistryTautomerSpectral lineBond lengthchemistry.chemical_compoundDipolechemistryPhysical chemistryComplete active spaceEmission spectrumPhysical and Theoretical ChemistryPhys. Chem. Chem. Phys.
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Inhibitoren der Korrosion 30 (1,2) - Vergleichende Studien über das Verhalten bekannter und bisher unbekannter Inhibitoren der Korrosion des Kupfers …

1985

Folgende Verbindungen wurden auf ihre Fahigkeit zur Inhibierung der Korrosion von Kupferproben unter Standardbedingungen uberpruft: Benzotriazol (BTA), 5-Aminotetrazol-monohydrat (5-AT), 2,5-Diphenyl-3-(m-chlorphenyl)-tetrazolium-nitrat (Tetrazin-B), α- und β-Naphthylamin, Phenylthioharnstoff, Xanthanwasserstoff, 2-Mercaptothiazolin (2-MT) und Kupferron. Folgende Messungen wurden durchgefuhrt: Bestimmung der Geschwindigkeit der Sauerstoffaufnahme im Schuttelversuch und pH-statische Verfolgung des Korrosionsverlaufs in Abhangigkeit (a) von der Konzentration des Inhibitors, (b) dem Verteilungszustand der Kupferprobe (Korn, Staub, Blech), (c) der Anwesenheit von Cu2+-Ionen und (d) dem pH-Wert.…

BenzotriazoleChemistryMechanical EngineeringMetals and Alloyschemistry.chemical_elementGeneral MedicineCopperSurfaces Coatings and Filmschemistry.chemical_compoundMechanics of MaterialsMaterials ChemistryCupferronEnvironmental ChemistryAmmoniumNuclear chemistryMaterials and Corrosion
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