Search results for "SPECTRA"

showing 10 items of 3542 documents

High-resolution photoacoustic Raman spectroscopy of gases

1992

A high-resolution photoacoustic Raman spectroscopy experiment is described. The resolution achieved by using two single-mode pulsed lasers is about 0.0054 cm −1 (full width at half maximum intensity). The experiment was tested first on the v 1 /2v 2 bands of CO 2 and gave an increase of at least about one order of magnitude in the signal-to-noise ratio with respect to stimulated Raman spectroscopy at low pressure (ca. 10 Torr ≃ 1.3 kPa). The sensitivity is also demonstrated by the study of the weak hot band v 1 +v 2 −v 2 of CO 2 . In both cases, the experimental line shape is well reproduced by taking into account Doppler and collisional effects. A comparison with CARS spectra was also made

ChemistryResolution (electron density)Analytical chemistryLaserHot bandSpectral linelaw.inventionsymbols.namesakeFull width at half maximumlawsymbolsGeneral Materials ScienceRaman spectroscopySpectroscopyDoppler effectSpectroscopyJournal of Raman Spectroscopy
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Orbital-Resolved Partial Charge Transfer from the Methoxy Groups of Substituted Pyrenes in Complexes with Tetracyanoquinodimethane—A NEXAFS Study

2012

It is demonstrated that the near-edge X-ray absorption fine structure (NEXAFS) provides a powerful local probe of functional groups in novel charge transfer (CT) compounds and their electronic properties. Microcrystals of tetra-/hexamethoxypyrene as donors with the strong acceptor tetracyano-p-quinodimethane (TMP/HMP-TCNQ) were grown by vapor diffusion. The oxygen and nitrogen K-edge spectra are spectroscopic fingerprints of the functional groups in the donor and acceptor moieties, respectively. The orbital selectivity of the NEXAFS pre-edge resonances allows us to precisely elucidate the participation of specific orbitals in the charge transfer process. Upon complex formation, the intensit…

ChemistryResonanceGeneral ChemistryPhotochemistryBiochemistryAcceptorTetracyanoquinodimethaneCatalysisXANESSpectral linechemistry.chemical_compoundPartial chargeColloid and Surface ChemistryAtomic orbitalSelectivityJournal of the American Chemical Society
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Triple-resonance autoionization of uranium optimized for diode laser excitation

2007

Abstract The photoionization of uranium via three-step excitation has been optimized for isotope selective trace analysis. A search found 13 new J = 6, 7, and 8 odd-parity states in the 36,850–37,200 cm− 1 region that allow blue–red–red three-photon excitation at wavelengths favorable for commercial diode laser systems. From each of these 13 states, near-threshold autoionization spectra were recorded at a resolution of 3 × 10− 4 cm− 1. Some 30 even-parity autoionizing levels with J = 5 to 9 have also been observed and characterized. Comparison of the spectra allows J assignment for the new intermediate levels as well as selection of an optimized path for trace analysis. We show that, for a …

ChemistryResonancePhotoionizationLaserAtomic and Molecular Physics and OpticsSpectral lineAnalytical ChemistrySemiconductor laser theorylaw.inventionAutoionizationlawAtomic physicsSpectroscopyInstrumentationSpectroscopyExcitationSpectrochimica Acta Part B: Atomic Spectroscopy
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Spectral investigation of spin echo emission

1993

Abstract The spectral content of the echo radiation emitted after a two-pulse sequence is measured in a two-level spin system. The spectral profiles exhibit maxima and zeroes of spectral density depending on the exciting sequence parameters. A calculation based on a vectorial model relates the zeroes to those packets that happen to be transparent to the second (refocusing) pulse. Moreover we report on a new spectral narrowing effect which we tentatively ascribe to the instantaneous diffusion.

ChemistrySpectral densityPulse sequenceGeneral ChemistryRadiationCondensed Matter PhysicsComputational physicsPulse (physics)Nuclear magnetic resonanceSpectral envelopeMaterials ChemistrySpin echoDiffusion (business)MaximaSolid State Communications
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Authentication of protected designation of origin artichokes by spectroscopy methods

2016

Abstract Artichoke samples with the protected designation of origin (PDO) ‘Alcachofa de Benicarlo’ were discriminated from those produced in other towns surrounding Valencia and Murcia, outside the PDO frame. Inductively coupled plasma (ICP-OES), near infrared (NIR) and X-ray fluorescence (XRF) were assayed in order to achieve a correct sample classification of the three different origin sample groups (Benicarlo, Valencia and Murcia). Chemometrics was used to compare the ability of classification of artichoke from their origin by using concentration data of mineral elements, determined by ICP-OES, NIR spectra and XRF spectra. Multivariate analysis tools, as principal component analysis (PCA…

ChemistrySpectroscopy methods010401 analytical chemistryAnalytical chemistry04 agricultural and veterinary sciences040401 food science01 natural sciencesData treatment0104 chemical sciencesChemometrics0404 agricultural biotechnologySample classificationPrincipal component analysisNir spectraFood ScienceBiotechnologyFood Control
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A statistical study of the additivities of substituent effects in the13C NMR chemical shifts of hydroxy- and chloro-substituted benzenes

1980

The 13C NMR spectra of six hydroxybenzenes, all chlorobenzenes, all chlorophenols and eight chlorocatechols are measured and assigned. The additivity of the substituent effects and the usefulness of some corrective parameters are studied with regression analysis. The order of the chemical shifts is most efficiently predicted by the simplest substituent effect model, containing only the direct effects of the substituents, although the 95% confidence limits of the calculated shifts are as high as 5.6 ppm. If the chemical shifts need to be predicted within the measuring errors (approximately 0.05–0.10 ppm, in the present data), the number of necessary corrections is very impractical. The corre…

ChemistryStereochemistryChemical shiftDirect effectsSubstituentGeneral ChemistryCarbon-13 NMRSpectral lineSolventchemistry.chemical_compoundChlorobenzeneComputational chemistryAdditive functionGeneral Materials ScienceOrganic Magnetic Resonance
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Synthesis, Crystal Structure, and Properties of Multicomponent Bis(ethylenedithio)tetrathiafulvalene Charge-Transfer Salts of the [Mo3S7Br6]2- Cluster

2005

A new family of bis(ethylenedithio)tetrathiafulvalene (ET) radical salts has been prepared in the presence of a triangular molybdenum sulfide cluster of formula [Mo 3 S 7 Br 6 ] 2 - , which contains highly electrophilic axialsulfur atoms. A systematic change in the experimental conditions yields five different salts, namely (ETA)2(ET B )[Mo 3 S 7 Br 6 ] 2 . CH 2 Br 2 (1), (ETA)(ET B )Mo 3 S 7 Br 6 ].1.1CH 2 Br 2 (2), (ETA)(ETB)(ET C ){[Mo 3 S 7 Br 6 ]Br}.0.5C 2 H 4 Cl 2 (3), (ET)((n-Bu 4 )N)-[Mo 3 S 7 Br 6 ] (4), and (ET)(Ph4P)[Mo 3 S 7 Br 6 ].0.5CH 3 CN (5), where the ET subscript denotes crystallographically independent molecules. The five compounds have been structurally characterized, a…

ChemistryStereochemistryCrystal structureTriclinic crystal systemSpectral lineInorganic ChemistryCrystallographysymbols.namesakechemistry.chemical_compoundElectrophilesymbolsMoleculePhysical and Theoretical ChemistryRaman spectroscopyStoichiometryTetrathiafulvaleneInorganic Chemistry
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Protonation of 3-aminopyrroles

1987

Abstract The protonation of 3-aminopyrroles has been investigated using H and 13C n.m.r. spectroscopy. The spectral data are compatible with predominant protonation of the amino group with no evidence for protonation of the pyrrole ring.

ChemistryStereochemistryNuclear TheoryOrganic ChemistryProtonationNuclear magnetic resonance spectroscopyRing (chemistry)BiochemistryMedicinal chemistrychemistry.chemical_compoundDrug DiscoveryPhysics::Accelerator PhysicsChemical solutionNuclear ExperimentSpectroscopySpectral dataPyrroleTetrahedron
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Über polygermane

1980

Abstract A complete series of 5-membered heterocycles (Ph 2 Ge) 4 X with X = O, S, Se and Te has been prepared and investigated by mass spectra, 13 C NMR spectra and vibrational spectra. The 13 C signals of the phenyl groups in the compounds (Ph 2 Ge) 4 X were compared with the related values in the homocycle (Ph 2 Ge) 5 . Frequency values for the symmetrical and asymmetrical stretching vibrations of the units GeGeGe and GeXGe are given. The crystal structure of the compound (Ph 2 Ge) 4 S has been determined and refined to a R of 0.051. The 5-membered ring Ge 4 S exhibits envelope conformation.

ChemistryStereochemistryOrganic ChemistryCrystal structureCarbon-13 NMRRing (chemistry)BiochemistrySpectral lineInorganic ChemistryCrystallographyMaterials ChemistryMass spectrumPhysical and Theoretical ChemistryVibrational spectraEnvelope (waves)Journal of Organometallic Chemistry
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Experimental and theoretical investigations of structural isomers of dichalcogenoimidodiphosphinate dimers: dichalcogenides or spirocyclic contact io…

2007

A synthetic protocol for the tert-butyl-substituted dichalcogenoimidodiphosphinates [Na(tmeda){(EPtBu(2))(2)N}] (3 a, E=S; 3 b, E=Se; 3 c, E=Te) has been developed. The one-electron oxidation of the sodium complexes [Na(tmeda){(EPR(2))(2)N}] with iodine produces a series of neutral dimers (EPR(2)NPR(2)E--)(2) (4 b, E=Se, R=iPr; 4 c, E=Te, R=iPr; 5 a, E=S, R=tBu; 5 b, E=Se, R=tBu; 5 c, E=Te, R=tBu). Attempts to prepare 4 a (E=S, R=iPr) in a similar manner produced a mixture including HN(SPiPr(2)). Compounds 4 b, 4 c and 5 a-c were characterised by multinuclear NMR spectra and by X-ray crystallography, which revealed two alternative structures for these dimeric molecules. The derivatives 4 b,…

ChemistryStereochemistryOrganic ChemistryGeneral ChemistryCatalysisIonlaw.inventionNMR spectra databaseChalcogenCrystallographychemistry.chemical_compoundMonomerlawStructural isomerMoleculeElectron paramagnetic resonanceIsopropylChemistry (Weinheim an der Bergstrasse, Germany)
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