Search results for "Spectroscopy"

showing 10 items of 10293 documents

Small angle scattering study of the structure of isotactic polypropylene-hydrogenated oligo(cyclopentadiene) blends

1996

Abstract Blends of isotactic polypropylene ( i PP) and hydrogenated oligo cyclopentadiene (HOCP) have been studied by means of small angle X-ray scattering in the temperature range 70–160°C. The structure of blends containing less than 25% HOCP is very similar to the one of plain i PP, i.e. lamellae whose thickness increases by increasing the temperature. Blends containing more than 25% HOCP are characterized by two kinds of lamellae formed by layers of i PP and amorphous material rich in i PP and in HOCP, respectively. The crystallizable i PP present in both phases crystallizes from the melt, in analogy to what happens in HDPE/HOCP blends and in agreement with the values of the crystallini…

chemistry.chemical_classificationSmall-angle X-ray scatteringOrganic ChemistryPolymerAtmospheric temperature rangeAnalytical ChemistryAmorphous solidInorganic ChemistryCrystallinitychemistryChemical engineeringTacticityPolymer chemistryHigh-density polyethylenePolymer blendSpectroscopyJournal of Molecular Structure
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Some observations on the determination of sulfite by reduction to sulfide with sodium borohydride

1987

Abstract Sodium borohydride is studied as an agent for reducing sulfite to sulfide. Rapid reductions are attained with greater than 97% recovery in the range 700–1200 μg of S/50 ml. Sulfate is not reduced.

chemistry.chemical_classificationSodium borohydridechemistry.chemical_compoundchemistrySulfideSulfiteInorganic chemistrySulfateSpectroscopyAnalytical ChemistryMicrochemical Journal
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FT-IR and dielectric study of water/AOT liquid crystals

2000

Abstract In order to explore the influence of microwave radiation on highly viscous microheterogeneous systems, the evolution of structural and dynamical properties of the water/sodium bis(2-ethylhexyl) sulfosuccinate (AOT) liquid crystals as a function of the molar ratio R (R=[water]/[AOT]) has been investigated by FT-IR spectroscopy and time domain reflectometry. The study emphasises how the progressive hydration of the surfactant head groups is mainly responsible for the structural and dynamical evolution of water/AOT liquid crystals. In particular, it has been found that the state of water at lower R values is strongly perturbed, bulk-like water appears only at R>23 and the water/AOT in…

chemistry.chemical_classificationSodiumOrganic ChemistryAnalytical chemistryIonic bondingchemistry.chemical_elementDielectricAnalytical ChemistryInorganic ChemistrychemistryPulmonary surfactantLiquid crystalCounterionFourier transform infrared spectroscopySpectroscopySpectroscopyJournal of Molecular Structure
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A newin vitroapproach for the simultaneous determination of phase I and phase II enzymatic activities of human hepatocyte preparations

2007

Primary hepatocytes are still the best qualified in vitro system to anticipate drug metabolism in man. Recent advances in hepatocytes cryopreservation have notably increased their use not only for drug metabolism studies, but also for other applications such as cell transplantation. Evaluation of the drug-metabolizing competence of each hepatocytes preparation is needed. To date, the metabolic characterization of hepatocytes preparations relies on the assessment of phase I activities and the role of phase II enzymes receives little attention. A novel approach for the rapid assessment of the metabolic functionality of hepatocytes has been developed. A five-probe cocktail was used to simultan…

chemistry.chemical_classificationSpectrometry Mass Electrospray IonizationSulfotransferaseCYP3A4Organic ChemistryTandem mass spectrometryMetabolic Detoxication Phase IICryopreservationIn vitroAnalytical ChemistryGlucuronidaseEnzymeCytochrome P-450 Enzyme SystemBiochemistrychemistryTandem Mass SpectrometryHepatocytesHumansMetabolic Detoxication Phase IGlucuronosyltransferaseSulfotransferasesCells CulturedChromatography High Pressure LiquidSpectroscopyDrug metabolismRapid Communications in Mass Spectrometry
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Direct monitoring of spin state in dinuclear iron(II) coordination compounds

2001

So far there has been no direct method to determine the spin state of molecules in dinuclear iron(II) compounds. The molecular fractions of high-spin (HS) and low-spin (LS) species have been deduced from magnetic susceptibility and zero-field Mossbauer spectroscopy data irrespective of whether they belong to LS–LS, LS–HS and HS–HS pairs. However, the distinction of pairs becomes possible if Mossbauer measurements are carried out in an external magnetic field. The proposed method opens new possibilities in the study of spin crossover phenomena in dinuclear compounds.

chemistry.chemical_classificationSpin statesChemistryDirect methodGeneral Physics and AstronomyMagnetic susceptibilityCoordination complexMagnetic fieldCrystallographyNuclear magnetic resonanceSpin crossoverMössbauer spectroscopyMoleculeCondensed Matter::Strongly Correlated ElectronsPhysical and Theoretical ChemistryChemical Physics Letters
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HACANCOi : a new Hα-detected experiment for backbone resonance assignment of intrinsically disordered proteins

2020

AbstractUnidirectional coherence transfer is highly efficient in intrinsically disordered proteins (IDPs). Their elevated ps-ns timescale dynamics ensures long transverse (T2) relaxation times allowing sophisticated coherence transfer pathway selection in comparison to folded proteins. 1Hα-detection ensures non-susceptibility to chemical exchange with the solvent and enables chemical shift assignment of consecutive proline residues, typically abundant in IDPs. However, many IDPs undergo a disorder-to-order transition upon interaction with their target protein, which leads to the loss of the favorable relaxation properties. Long coherence transfer routes now result in prohibitively large dec…

chemistry.chemical_classificationSpinsbiologyChemistryGlobular proteinRelaxation (NMR)E. coliIDPGB1Intrinsically disordered proteinsintrinsically disordered proteinBiochemistryResonance (particle physics)Chemical physicsSNX9 SH3biology.proteinTarget proteinProtein GproteiinitNMR-spektroskopiaSpectroscopyEspFresonance assignmentCoherence (physics)
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Discrete bond model (DBM) of sodium silicate glasses derived from XPS, Raman and NMR measurements

1993

In sodium silicate glasses, the fraction of differently bound Si species Q[i] (i = 0−4), depending on the number i of bridging oxygens bound to the quarternary silicon, is a function of stoichiometry and the Na/Si ratio. Sodium silicate glasses were investigated by high resolution X-ray photoelectron spectroscopy. To explain the differences in chemical shifts and linewidths of the O 1s signal of the bridging and the non-bridging oxygen as a function of alkali concentration, and extended glass model was developed. This new model takes into account the influence of the alkali concentration on the Q[i] distribution and on the appearance and concentrations of differently bound bridging oxygens …

chemistry.chemical_classificationStereochemistryChemical shiftBinding energyCondensed Matter PhysicsAlkali metalElectronic Optical and Magnetic Materialssymbols.namesakeCrystallographychemistryX-ray photoelectron spectroscopyChemical bondMaterials ChemistryCeramics and CompositessymbolsRaman spectroscopyInorganic compoundStoichiometryJournal of Non-Crystalline Solids
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13C NMR study of aromatic ring-substituted (E)-3-phenylpropenals and (2E,4E)-5-phenylpenta-2,4-dienals

1990

13C and 1H chemical shifts together with C,H and H,H coupling constants are presented for (E)-3-phenylpropenal, (2E,4E)-5-phenylpenta-2,4-dienal and their o-OCH3- and o-, m- and p-NO2-substituted derivatives. The SCSs calculated for the aldehyde chains show similar effects on the ring carbons, except in the para position where the shorter chain causes a 3.3 ppm deshielding and the longer chain a 1.0 ppm shielding effect. This shift difference is reflected in all the ring-substituted derivatives of the two series of aldehydes, but not in the one-bond C,H coupling constants. The effect of aromatic ring substitution on 2J(C,CHO) seems to be mainly inductive in origin. The importance of the str…

chemistry.chemical_classificationStereochemistryChemical shiftEtherGeneral ChemistryNuclear magnetic resonance spectroscopyCarbon-13 NMRRing (chemistry)Aldehydechemistry.chemical_compoundCrystallographychemistryProton NMRGeneral Materials ScienceStructural unitMagnetic Resonance in Chemistry
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Über tetraaryl-methan-analoga in der gruppe 14

1994

Abstract The title compounds have been synthesized by Grignard reactions or pyrolysis of diplumbanes respectively. The crystal structures of m -Tol 4 Pb and Ph 4 Pb (redetermination) have been determined. All eight compounds (Ph/Tol) 4 (Sn/Pb) are S 4 symmetric and contracted along this unique axis. The 13 C-NMR chemical shifts and the couplings 1 J ( 119 Sn/ 207 Pb 13 C) as well depend additively upon the methyl substituents. The ratios 1 K ( 207 Pb 13 C): 1 K ( 119 Sn 13 C) of the reduced coupling constants are all near to 1.61; a comparison with values from the literature for alkyl, alkenyl and alkinyl substituents is given. The ratio δ( 207 Pb):δ( 119 Sn) results in 2.28. IR (700 dow…

chemistry.chemical_classificationStereochemistryChemical shiftOrganic ChemistryNuclear magnetic resonance spectroscopyCrystal structureGrignard reagentBiochemistryMedicinal chemistryInorganic Chemistrysymbols.namesakechemistryX-ray crystallographyMaterials ChemistrysymbolsMoleculePhysical and Theoretical ChemistryRaman spectroscopyAlkylJournal of Organometallic Chemistry
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1H,13C,17O and19F NMR spectroscopic study of isomeric ring-substituted monofluoro-(E)-3-phenylpropenals

1993

Isomeric ring substituted monofluoro-(E)-3-phenylpropenals (cinnamaldehydes) were synthesized in order to provide, with the NMR-active 19F nucleus, an insight into the influence of substituents and the transmission of electronic effects between the aromatic ring and the side-chain. Their 1H, 13C and 17O NMR chemical shifts and their nJ(H,H), nJ(H,F), nJ(C,H) and nJ(C,F) values were determined. Generally, the nJ(C,F) coupling constants correlate with the length of the coupling route and thus simplify the assignments of the 13C NMR spectra. Only the side-chain carbons C-2 and C-3 in the ortho-substituted compounds showed an exception to this rule. Many long-range nJ(H,F) (n = 4–7) values were…

chemistry.chemical_classificationStereochemistryChemistryChemical shiftSubstituentGeneral ChemistryFluorine-19 NMRNuclear magnetic resonance spectroscopyCarbon-13 NMRRing (chemistry)Medicinal chemistryAldehydechemistry.chemical_compoundElectronic effectGeneral Materials ScienceMagnetic Resonance in Chemistry
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