Search results for "Oct"

showing 10 items of 3052 documents

Designing binuclear transition metal complexes: a new example of the versatility of N,N′-bis(2-aminobenzyl)-4,13-diaza-18-crown-6

2005

[Abstract] N,N′-Bis(2-aminobenzyl)-4,13-diaza-18-crown-6 (L) is a versatile receptor able to adapt to the coordinative preferences of different metal cation guests. With first-row transition metal ions, L tends to form binuclear complexes but, depending on the nature of the particular metal ion, the structure of the binuclear complex may be very different. Herein we report a study of the structure and magnetic properties of the corresponding nickel(II) and cobalt(II) complexes. The X-ray crystal structure of the nickel complex (1), with formula [Ni2(L)(CH3CN)4](ClO4)4·CH3CN, shows that this compound presents a symmetric coordination environment with L adopting an anti arrangement. Each Ni(I…

Models MolecularMetal ions in aqueous solutionCoordination numberchemistry.chemical_elementCrystal structureCrystallography X-RayInorganic Chemistrychemistry.chemical_compoundMagneticsMacrocyclic ligandsTransition metalNickelCationsCrown EthersOrganometallic CompoundsCrown ethersAza Compounds18-Crown-6TemperatureBinuclear complexesCobaltCrystallographyNickelchemistryOctahedronCrystal structuresTransition-metal complexesCobalt
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New BDH-TTP/[MIII(C5O5)3]3– (M = Fe, Ga) Isostructural Molecular Metals

2012

Two new isostructural molecular metals-(BDH-TTP)(6)[M(III)(C(5)O(5))(3)]·CH(2)Cl(2) (BDH-TTP = 2,5-bis(1,3-dithiolan-2-ylidene)-1,3,4,6-tetrathiapentalene, where M = Fe (1) and Ga (2))-have been prepared and fully characterized. Compound 1 is a molecular conductor showing paramagnetic behavior, which is due to the presence of isolated [Fe(C(5)O(5))(3)](3-) complexes with high-spin S = (5)/(2) Fe(III) metal ions. The conductivity originates from the BDH-TTP organic donors arranged in a κ-type molecular packing. At 4 kbar, compound 1 behaves as a metal down to ∼100 K, showing high conductivity (∼10 S cm(-1)) at room temperature. When applying a pressure higher than 7 kbar, the metal-insulator…

Models MolecularMolecular StructureChemistryIronMetal ions in aqueous solutionGalliumStereoisomerismConductivityLigandsInorganic ChemistryMetalCrystalParamagnetismCrystallographyOctahedronvisual_artOrganometallic Compoundsvisual_art.visual_art_mediumFine structurePhysical and Theoretical ChemistryIsostructuralInorganic Chemistry
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Nautilus pompilius Hemocyanin: 9 Å Cryo-EM Structure and Molecular Model Reveal the Subunit Pathway and the Interfaces between the 70 Functional Units

2007

Hemocyanins are giant extracellular oxygen carriers in the hemolymph of many molluscs. Nautilus pompilius (Cephalopoda) hemocyanin is a cylindrical decamer of a 350 kDa polypeptide subunit that in turn is a "pearl-chain" of seven different functional units (FU-a to FU-g). Each globular FU has a binuclear copper centre that reversibly binds one O(2) molecule, and the 70-FU decamer is a highly allosteric protein. Its primary structure and an 11 A cryo-electron microscopy (cryo-EM) structure have recently been determined, and the crystal structures of two related FU types are available in the databanks. However, in molluscan hemocyanin, the precise subunit pathway within the decamer, the inter…

Models MolecularMolecular modelProtein Conformationmedicine.medical_treatmentProtein subunitMolecular Sequence DataOctopodiformesAllosteric regulationBiologyHemocyaninTurn (biochemistry)Protein structureStructural BiologyImage Processing Computer-AssistedmedicineAnimalsAmino Acid SequenceMolecular BiologyBinding SitesSequence Homology Amino AcidCryoelectron MicroscopyProtein primary structureHemocyaninCrystallographyHemocyaninsBiophysicsNautilusProtein quaternary structureJournal of Molecular Biology
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The Sequence of a Gastropod Hemocyanin (HtH1 from Haliotis tuberculata)

2000

The eight functional units (FUs), a-h, of the hemocyanin isoform HtH1 from Haliotis tuberculata (Prosobranchia, Archaeogastropoda) have been sequenced via cDNA, which provides the first complete primary structure of a gastropod hemocyanin subunit. With 3404 amino acids (392 kDa) it is the largest polypeptide sequence ever obtained for a respiratory protein. The cDNA comprises 10,758 base pairs and includes the coding regions for a short signal peptide, the eight different functional units, a 3'-untranslated region of 478 base pairs, and a poly(A) tail. The predicted protein contains 13 potential sites for N-linked carbohydrates (one for HtH1-a, none for HtH1-c, and two each for the other si…

Models MolecularSignal peptideDNA ComplementaryProtein subunitmedicine.medical_treatmentMolecular Sequence DataOctopodiformesBiologyBiochemistryEvolution MolecularArchaeogastropodaComplementary DNAmedicineAnimalsProtein IsoformsComputer SimulationAmino Acid SequenceMolecular BiologyPeptide sequencePhylogenyGene LibrarySequence Homology Amino AcidProtein primary structureHemocyaninCell BiologyAnatomybiology.organism_classificationRespiratory proteinBiochemistryMolluscaHemocyaninsProtein BindingJournal of Biological Chemistry
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Macrocyclic oligoureas with xanthene and diphenyl ether units

2009

Two cyclic oligoureas with 64- and 80-membered rings in which two sets of three or four rigid xanthene (X) units are connected via flexible diphenyl ether (D) units were synthesized by a stepwise fragment condensation. The compounds were characterized by (1)H NMR and ESI mass spectrometry. The structure of the cyclic octamer (XXXDXXXD) was additionally confirmed by single crystal X-ray analysis. The molecule assumes a strongly folded conformation with distorted C(2)-symmetry, stabilized by intramolecular hydrogen bonds. Surprisingly, intermolecular hydrogen bonds between the macrocycles were not observed. (1)H NMR spectra suggest a C(2) symmetrical conformation of the octamer in solution al…

Models MolecularXantheneMacrocyclic CompoundsMagnetic Resonance SpectroscopyPolymersHydrogen bondChemistryStereochemistryPhenyl EthersOrganic ChemistryDiphenyl etherIntermolecular forceMolecular ConformationCrystallography X-RayBiochemistryCrystallographychemistry.chemical_compoundXanthenesIntramolecular forceProton NMRMoleculeHistone octamerPhysical and Theoretical ChemistryOrganic & Biomolecular Chemistry
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Bis(diethylenetriamine-κ3N)nickel(II) 5-amino-1,3,4-thiadiazole-2-sulfonamidate chloride monohydrate

2000

In the X-ray crystal structure of the title complex, [Ni(C(4)H(13)N(3))(2)](C(2)H(3)N(4)O(2)S(2))Cl.H(2)O, the coordination polyhedron is composed of non-centrosymmetric [Ni(diethylenetriamine)(2)](2+) cations in which the triamine ligands coordinate to the metal centre as tridentate ligands in a facial position. The Ni(II) ions are linked to six N atoms in an octahedral arrangement, slightly compressed in one extreme. The sulfonamide behaves as a counter-ion instead of as a ligand. Important information about the deprotonated sulfonamide group conformation has been obtained.

Models Molecularchemistry.chemical_classificationSulfonamidesStereochemistryLigandchemistry.chemical_elementHydrogen BondingGeneral MedicineCrystal structureCrystallography X-RayMedicinal chemistryGeneral Biochemistry Genetics and Molecular BiologySulfonamidechemistry.chemical_compoundNickelchemistryOctahedronDiethylenetriamineOrganometallic CompoundsAmine gas treatingDiazoCarbonic Anhydrase InhibitorsActa Crystallographica Section C Crystal Structure Communications
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Isostructural Inorganic–Organic Piperazine-1,4-diium Chlorido- and Bromidoantimonate(III) Monohydrates: Octahedral Distortions and Hydrogen Bonds

2020

Halogenidoantimonate(III) monohydrates of the (C4H12N2)[SbX5]&middot

Models Molecularcrystal structureMaterials scienceHydrogenSurface PropertiesMolecular ConformationPharmaceutical Sciencechemistry.chemical_elementCrystal structurelow temperatureArticleAnalytical Chemistrylcsh:QD241-441lcsh:Organic chemistryDrug DiscoveryMoleculeHirshfeld surface analysisPhysical and Theoretical ChemistryIsostructuralOrganic Chemicalsoctahedral distortionPiperazineHydrogen bondOrganic Chemistryhydrogen bondinginorganic–organic hybrid materialsCrystallographyOctahedronchemistryChemistry (miscellaneous)Inorganic ChemicalsMolecular MedicineWater of crystallizationhalogenidoantimonates(III)Monoclinic crystal systemMolecules
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Subunit organization of the abalone Haliotis tuberculata hemocyanin type 2 (HtH2), and the cDNA sequence encoding its functional units d, e, f, g and…

1999

We have developed a HPLC procedure to isolate the two different hemocyanin types (HtH1 and HtH2) of the European abalone Haliotis tuberculata. On the basis of limited proteolytic cleavage, two-dimensional immunoelectrophoresis, PAGE, N-terminal protein sequencing and cDNA sequencing, we have identified eight different 40-60-kDa functional units (FUs) in HtH2, termed HtH2-a to HtH2-h, and determined their linear arrangement within the elongated 400-kDa subunit. From a Haliotis cDNA library, we have isolated and sequenced a cDNA clone which encodes the five C-terminal FUs d, e, f, g and h of HtH2. As shown by multiple sequence alignments, defg of HtH2 correspond structurally to defg from Octo…

Models Molecularfood.ingredientDNA ComplementarySequence analysismedicine.medical_treatmentMolecular Sequence DataOctopodiformesMegathura crenulataBiochemistryEvolution MolecularfoodSequence Analysis ProteinComplementary DNAmedicineAnimalsHaliotisAmino Acid SequenceCloning MolecularProtein Structure QuaternaryPeptide sequenceImmunoelectrophoresisbiologySequence Homology Amino AcidcDNA libraryHelix SnailsProtein primary structureHemocyaninAnatomySequence Analysis DNAbiology.organism_classificationPeptide FragmentsBiochemistryMolluscaHemocyaninsEuropean journal of biochemistry
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Interactions of zinc octacarboxyphthalocyanine with selected amino acids and with albumin

2015

Effect of selected amino acids (glycine, l-histidine, l-cysteine, l-serine, l-tryptophan) and albumin on the spectroscopic properties and photostability of zinc octacarboxyphthalocyanine (ZnPcOC) was explored in the phosphate buffer at a pH of 7.0. The photodegradation of ZnPcOC alone and in the presence of amino acids or albumin has been investigated in aqueous phase using UV-366 nm and daylight irradiation. Kinetic analysis showed that the interaction with amino acids or albumin enhances the photostability of ZnPcOC. To answer the question of how zinc phthalocyanine interacts with amino acids extensive DFT calculations were performed. Analysis of the optimized geometry features of ZnPcOC:…

Models Molecularzinc octacarboxyphthalocyanineIndolesUltraviolet Rayschemistry.chemical_element02 engineering and technologyZincIsoindoles010402 general chemistryPhotochemistry01 natural sciencesAnalytical Chemistrychemistry.chemical_compoundPolymer chemistryOrganometallic CompoundsWater environmentAnimalsAmino AcidsPhotodegradationInstrumentationSpectroscopytheoretical calculationschemistry.chemical_classificationPhotolysisAqueous two-phase systemAlbuminSerum Albumin BovineUV–Vis spectra021001 nanoscience & nanotechnologyAtomic and Molecular Physics and Optics0104 chemical sciencesAmino acidphotodynamic therapychemistryZinc CompoundsGlycinePhthalocyanineCattleSpectrophotometry Ultravioletprotein0210 nano-technologyDimerizationamino acidSpectrochimica Acta Part A: Molecular and Biomolecular Spectroscopy
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La difficile taxinomie des situations intermédiaires sur le marché du travail : une illustration à partir du processus d'insertion des docteurs

2001

Actes des 8èmes journées d'études Céreq/Lasmas-Institut du Longitudinal, L'analyse longitudinale du marché du travail, Marseille, 17 et 18 mai 2001; International audience; This paper attempts to analyse the recent labour market prospects for scientific PhD graduates in France. Firstly, we propose an assessment of the labour market situation of PhD graduates three years after the completion of their theses, using a standard categorical analysis of labour market activities. Secondly, we use unemployment durations to study the difficulties PhD graduates encounter when they enter the labour market.

Modélisation[SHS.EDU]Humanities and Social Sciences/Education[SHS.EDU] Humanities and Social Sciences/EducationAccès à l'emploiInsertion professionnelle[SHS.ECO] Humanities and Social Sciences/Economics and FinanceDocteur de troisième cycle[SHS.ECO]Humanities and Social Sciences/Economics and FinanceEnseignement supérieurFilière sciences
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