Search results for "METHANE"

showing 10 items of 1763 documents

Model, software and database for line-mixing effects in the nu3 and nu4 bands of CH4 and tests using laboratory and planetary measurements - II : H2 …

2006

International audience; The absorption shapes of the nu(2), nu(3) and nu(4) infrared bands of CH4 perturbed by H-2 in large ranges of pressure and temperature have been measured in the laboratory. In order to model these spectra, the theoretical approach accounting for line-mixing effects proposed for CH4-N-2 and CH4-air and successfully tested in the companion paper (1), is used. As before, state-to-state rotational rates are used together with some empirical parameters that are deduced from a fit of a single room temperature spectrum of the nu(3) band at about 50 atm. The comparisons between measured and calculated spectra in the nu(3) and nu(4) regions under a vast variety of conditions …

Spectral shape analysis010504 meteorology & atmospheric sciencesInfraredcomputer.software_genre01 natural sciences7. Clean energyJovianSpectral line0103 physical sciencesRadiative transferAbsorption (electromagnetic radiation)Spectroscopy0105 earth and related environmental sciencesLine (formation)Physics[PHYS.PHYS.PHYS-AO-PH]Physics [physics]/Physics [physics]/Atmospheric and Oceanic Physics [physics.ao-ph]Radiation010304 chemical physicsSpectrometerDatabasemethane infrared spectraAtomic and Molecular Physics and Optics[ PHYS.PHYS.PHYS-AO-PH ] Physics [physics]/Physics [physics]/Atmospheric and Oceanic Physics [physics.ao-ph]13. Climate actionAstrophysics::Earth and Planetary Astrophysicscomputergiant planets emission
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Potent Aroma Compounds of Two Red Wine Vinegars

2000

Gas chromatography olfactometry (GCO) was used to determine key aroma compounds of two red wine vinegars. Sensory analysis was performed to choose the best neutralization agent of acetic acid (NaOH or MgO) and to test representativeness of four extracts obtained by different methods (dichloromethane extraction, XAD-2, mixture of XAD-2 and XAD-7, and Extrelut resins extraction). Neutralization with NaOH followed by dichloromethane extraction was selected to extract volatile compounds of vinegars. Key odorant compounds were determined by GCO based on detection frequency with 13 people. In the two red wine vinegars, 13 odors were perceived by at least 70% of the panelists, and 8 compounds amon…

Spectrophotometry InfraredAcrylic ResinsWine01 natural sciencesGas Chromatography-Mass SpectrometryButyric acidAcetic acidchemistry.chemical_compound0404 agricultural biotechnology[SDV.IDA]Life Sciences [q-bio]/Food engineeringComputingMilieux_MISCELLANEOUSAromaAcetic AcidDichloromethaneWineChromatographybiology010401 analytical chemistryExtraction (chemistry)04 agricultural and veterinary sciencesGeneral Chemistry[SDV.IDA] Life Sciences [q-bio]/Food engineeringbiology.organism_classification040401 food science0104 chemical scienceschemistryOdorPolystyrenesIon Exchange ResinsGas chromatographyGeneral Agricultural and Biological SciencesJournal of Agricultural and Food Chemistry
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"Expanded" local mode approach and isotopic effect in polyatomic molecules

2014

In this thesis, on the base of the "expanded", local mode approach and general isotopic substitution theory we obtain sets of simple analytical relations between spectroscopic parameters (harmonic frequencies, anharmonic coefficients, ro-vibrational parameters, different kinds of Fermi and Coriolis-type interaction parameters) of the CH2D2, CH3D and CHD3 molecules. All of them are expressed as simple functions of spectroscopic parameters of the mother CH4 molecule. Test calculations with the isotopic relations show that even without including prior informations about the isotopic species, numerical results of calculations are in a good agreement both with experimental data and results of ab…

Spectroscopie moléculaireEspèces deutéréesLe modèle mode local[PHYS.PHYS]Physics [physics]/Physics [physics]Deuterated speciesRotational and vibrational parametersParamètres rotationnels et vibrationnels[ PHYS.PHYS ] Physics [physics]/Physics [physics]Molecular spectroscopyLocal mode modelFonction potentiel intramoléculaireMolécule de méthaneRelations isotopiques[PHYS.PHYS] Physics [physics]/Physics [physics]Isotopic relationsMethane moleculeIntramolecular potential function
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Mono- and di-nuclear complexes of ortho-palladated and -platinated 4,4′-dimethylazobenzene with bis(diphenylphosphino)methane. More data on transphob…

2002

Abstract Complexes [Pd(κ2-R)(μ-Cl)]2 [κ2-R=κ2-C,N′-C6H3(NNC6H4Me-4′)-2-Me-5 (1)] and [Pd(κ1-R)Cl(κ1-dppm)(κ2-dppm)]TfO [dppm=bis(diphenylphosphino)methane (2)] have been used to prepare new palladium derivatives containing dppm. Thus, complex 1 reacts with one equivalent of dppm to afford [{Pd(κ2-R)Cl}2(μ-dppm)] (3) and with AgClO4 and dppm (1:2:2 molar ratios) to give [Pd(κ2-R)(κ2-dppm)]ClO4 (4·ClO4). The triflate salt of this complex (4·TfO) reacts with PPh3 to yield [Pd(κ1-R)(PPh3)(κ2-dppm)]TfO (5). Dinuclear complexes were obtained by reacting 2, (i) with [AuCl(PPh3)] or [AuCl(tht)] (tht=tetrahydrothiophene) (1:1, −60 °C) and (ii) with 1 (2:1) to give, respectively, [Pd(κ1-R)Cl(μ-dppm…

StereochemistryArylDimerOrganic Chemistrychemistry.chemical_elementMonoxideCrystal structureBiochemistryMedicinal chemistryInorganic Chemistrychemistry.chemical_compoundchemistryMaterials ChemistryChelationPhysical and Theoretical ChemistryTrifluoromethanesulfonateTetrahydrothiophenePalladiumJournal of Organometallic Chemistry
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Enantioselective synthesis of herbertane sesquiterpenes: synthesis of (−)-α-formylherbertenol

2000

Abstract The synthesis of 4-hydroxy-3-[(1 S )-1,2,2-trimethylcyclopentyl]benzaldehyde [(−)-α-formylherbertenol 1 ], a herbertane-type sesquiterpene isolated from the leafy liverwort Herberta adunca , from β-cyclogeraniol is described. The synthesis is based on the previously described preparation of an enantiopure 1,2,2-trimethylcyclopentane synthon from which the characteristic aromatic moiety of 1 is elaborated, using a Robinson annulation and a palladium-catalysed methoxycarbonylation of an aryl triflate as key synthetic steps. The synthesis of the natural sesquiterpene (−)-α-herbertenol, also a natural sequiterpene, using the same methodology is also described.

StereochemistryChemistryArylOrganic ChemistrySynthonEnantioselective synthesisSesquiterpeneCatalysisInorganic ChemistryBenzaldehydechemistry.chemical_compoundEnantiopure drugRobinson annulationOrganic chemistryPhysical and Theoretical ChemistryTrifluoromethanesulfonateTetrahedron: Asymmetry
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Unique regioselectivity in the C(sp3)-H α-alkylation of amines: the benzoxazole moiety as a removable directing group.

2014

The benzoxazol-2-yl- substituent was found to act as a removable activating and directing group in the Ir-catalyzed alkylation of C(sp(3))-H bonds adjacent to nitrogen in secondary amines. It can be easily introduced by oxidative coupling or by an SNAr reaction, and it can be removed by hydroxide or by hydride reduction. For 1,2,3,4-tetrahydroisoquinolines, activation exclusively takes place in the 3-position. A variety of activated as well as unactivated terminal olefins are suitable reaction partners.

StereochemistryHydrideOrganic ChemistrySubstituentRegioselectivityAlkylationBenzoxazoleBiochemistryMedicinal chemistrychemistry.chemical_compoundchemistryNucleophilic aromatic substitutionMoietyOxidative coupling of methanePhysical and Theoretical ChemistryOrganic letters
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Gold(I) Biscarbene Complexes Derived from Vascular-Disrupting Combretastatin A-4 Address Different Targets and Show Antimetastatic Potential

2014

Gold N-heterocyclic carbene (NHC) complexes are an emerging class of anticancer drugs. We present a series of gold(I) biscarbene complexes with NHC ligands derived from the plant metabolite combretastatin A-4 (CA-4) that retain its vascular-disrupting effect, yet address different cellular and protein targets. Unlike CA-4, these complexes did not interfere with tubulin, but with the actin cytoskeleton of endothelial and cancer cells. For the highly metastatic 518A2 melanoma cell line this effect was accompanied by a marked accumulation of cells in the G1 phase of the cell cycle and a suppression of active prometastatic matrix metalloproteinase-2. Despite these mechanistic differences the co…

StereochemistryNeovascularization PhysiologicAntineoplastic AgentsBiologyBiochemistryMicechemistry.chemical_compoundCoordination ComplexesTubulinCell Line TumorBibenzylsDrug DiscoveryHuman Umbilical Vein Endothelial CellsAnimalsHumansGeneral Pharmacology Toxicology and PharmaceuticsMelanomaCell ProliferationPharmacologyCombretastatin A-4Tube formationCombretastatinMice Inbred BALB COrganic ChemistryCell cycleActin cytoskeletonG2 Phase Cell Cycle CheckpointsActin CytoskeletonChorioallantoic membranechemistryDrug Resistance NeoplasmCell cultureCancer cellMCF-7 CellsCancer researchMolecular MedicineGoldHT29 CellsMethaneChemMedChem
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Clerodane diterpenoids from Salvia splendens.

2006

Four new clerodane diterpenoids, salvisplendins A-D (1-4), have been isolated from an acetone extract of the flowers of SalVia splendens, together with an artifact (5), arising from salvisplendin D (4) by addition of diazomethane, and the already known clerodane olearin (6). The structures of the new compounds (1-5) were established mainly by 1D and 2D NMR spectroscopic studies and, in the case of salvisplendin A (1), by chemical correlation with splenolide B (7). Complete 1H and 13C NMR assignments for olearin (6), not published hitherto, are also reported.

StereochemistryPharmaceutical ScienceFlowersSalviaAnalytical ChemistryDiterpenes Clerodanechemistry.chemical_compoundFour new clerodane diterpenoids salvisplendins A-D (1-4) have been isolated from an acetone extract of the flowers of SalVia splendens together with an artifact (5) arising from salvisplendin D (4) by addition of diazomethane and the already known clerodane olearin (6). The structures of the new compounds (1-5) were established mainly by 1D and 2D NMR spectroscopic studies and in the case of salvisplendin A (1) by chemical correlation with splenolide B (7). Complete 1H and 13C NMR assignments for olearin (6) not published hitherto are also reportedDrug DiscoveryOrganic chemistrySalviaNuclear Magnetic Resonance BiomolecularPharmacologychemistry.chemical_classificationPlants MedicinalbiologyMolecular StructureChemistryDiazomethaneOrganic ChemistryCarbon-13 NMRbiology.organism_classificationChemical correlationTerpenoidComplementary and alternative medicineItalyMolecular MedicineDiterpeneTwo-dimensional nuclear magnetic resonance spectroscopyLactoneJournal of natural products
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Modeling the Geometric, Electronic, and Redox Properties of Iron(III)-Containing Amphiphiles with Asymmetric [NN′O] Headgroups

2011

Two iron(III)-containing amphiphiles 1 and 2 have been synthesized with the [NN'O] ligands HL(tBu-ODA) (2-((octadecyl(pyridin-2-ylmethyl)amino)methyl)-4,6-di-tert-butylphenol) and HL(I-ODA) (2-((octadecyl(pyridin-2-ylmethyl)amino)methyl)-4,6-diiodophenol), respectively. Compound 1 is monometallic, whereas EXAFS data suggest that 2 is a mixture of mono- and bimetallic species. The archetypical [Fe(III)(L(NN'O))(2)](+) complexes 3-9 have been isolated and characterized in order to understand the geometric, electronic, and redox properties of the amphiphiles. Preference for a monometallic or bimetallic nuclearity is dependent on (i) the nature of the solvent used for synthesis and (ii) the typ…

StereochemistrySubstituentMedicinal chemistryRedoxInorganic ChemistrySolventchemistry.chemical_compoundDeprotonationchemistryMoleculeMoietyPhysical and Theoretical ChemistryBimetallic stripDichloromethaneInorganic Chemistry
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Versatile synthesis of cationic N-heterocyclic carbene–gold(i) complexes containing a second ancillary ligand. Design of heterobimetallic ruthenium–g…

2016

We describe a versatile and quick route to cationic gold(i) complexes containing N-heterocyclic carbenes and a second ancillary ligand (such as phosphanes, phosphites, arsines and amines) of interest for the synthesis of compounds with potential catalytic and medicinal applications. The general synthetic strategy has been applied in the preparation of novel cationic heterobimetallic ruthenium(ii)-gold(i) complexes that are highly cytotoxic to renal cancer Caki-1 and colon cancer HCT 116 cell lines while showing a synergistic effect and being more selective than their monometallic counterparts.

Stereochemistrychemistry.chemical_elementLigands010402 general chemistry01 natural sciencesArticleRutheniumCatalysisCatalysischemistry.chemical_compoundHeterocyclic CompoundsCationsMaterials Chemistry010405 organic chemistryChemistryLigandSecond ancillaryMetals and AlloysCationic polymerizationGeneral ChemistryCombinatorial chemistry0104 chemical sciencesSurfaces Coatings and FilmsElectronic Optical and Magnetic MaterialsRutheniumCeramics and CompositesGoldMethaneCarbeneChemical Communications
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