Search results for "Spectroscopy"

showing 10 items of 10293 documents

Über gemischte gruppe 14-gruppe 14-bindungen

1993

Abstract The lead-tin compounds o-Tol6PbSn, o-Tol3PbSnPh3 and Mes3PbSnPh3 have been synthesized from Li and halide precursors in THF/ether at low temperatures. The crystal structures of the S4 symmetric o-Tol4Pb and of the three isomorphous title compounds have been determined (d(SnSn) 2.883 (1), d (PbSn) 2.845 (2), d (PbPb) 2.895 (2), A). The long SnSn distance is in accordance with the Raman data for the pairs of p-Tol6/o-Tol6 substituents (ν(SnSn) 131/123, ν(PbSn) 114/114, ν(PbPb) 105/103 cm−1). The sequence of the 119Sn and 207Pb chemical shifts shows clearly a polarity Pbδ−Snδ+ for all lead-tin compounds investigated. The 1J (119Sn207Pb) and 1J(119Sn119Sn) couplings of identi…

Carbon groupChemistryStereochemistryArylChemical shiftOrganic ChemistryHalideEtherCrystal structureBiochemistryInorganic ChemistryCrystallographychemistry.chemical_compoundsymbols.namesakeMaterials ChemistrysymbolsPhysical and Theoretical ChemistryRaman spectroscopyJournal of Organometallic Chemistry
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An ab initio study of the relation between NMR chemical shifts and solid-state structures: hexabenzocoronene derivatives

2000

The assignment of solid-state NMR spectra is studied by the use of model systems computed with ab initio methods. The investigated system is a hexabenzocoronene derivative, for which a T-like arrangement of dimer units is found in the solid-state structure. Here, a tetramer model is required to explain the intermolecular interactions influencing the spectrum, whereas a dimer model is found to be inadequate. For the tetramer model, agreement of the computed NMR spectrum with the experimental solid-state magic angle spinning MAS-NMR data is observed. This study implies that the combination of experimental NMR data with quantum chemical calculations can be employed as a useful tool in determin…

Carbon-13 NMR satelliteChemical shiftIntermolecular forceAb initioGeneral Physics and AstronomyNuclear magnetic resonance spectroscopyNMR spectra databaseCrystallographychemistry.chemical_compoundHexabenzocoronenechemistryPhysics::Atomic and Molecular ClustersMagic angle spinningCondensed Matter::Strongly Correlated ElectronsPhysical and Theoretical ChemistryPhysical Chemistry Chemical Physics
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New Tetrahydro-1,2,4,5-Tetrazinan-3-Ones and Oxoverdazyl Free Radicals

2006

A series of tetrahydro-1,2,4,5-tetrazinan-3-ones have been prepared by the reaction of carbonic acid bis (1-methylhydrazide) with aromatic aldehydes. These were oxidised to oxoverdazyl free radicals and used immediately for ESR spectroscopy studies that indicate that the unpaired electron is delocalised over the verdazyl ring. The ESR spectra can be very well simulated considering hyperfine couplings with the four nitrogen atoms of the verdazyl ring and the six hydrogen atoms of the two methyl groups bonded to it.

Carbonic acidHydrogen010405 organic chemistryChemistryRadicalchemistry.chemical_elementGeneral MedicineGeneral Chemistry010402 general chemistryRing (chemistry)Nitrogen01 natural sciences0104 chemical scienceslaw.inventionchemistry.chemical_compoundUnpaired electronComputational chemistrylawPolymer chemistrySpectroscopyElectron paramagnetic resonanceHyperfine structureJournal of Chemical Research
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Analysis of Organic Aerosols Using a Micro-Orifice Volatilization Impactor Coupled to an Atmospheric-Pressure Chemical Ionization Mass Spectrometer

2014

We present the development and characterization of a combination of a micro-orifice volatilization impactor (MOVI) and an ion trap mass spectrometer (IT/MS) with an atmospheric-pressure chemical ionization (APCI) source. The MOVI is a multi-jet impactor with 100 nozzles, allowing the collection of aerosol particles by inertial impaction on a deposition plate. The pressure drop behind the nozzles is approximately 5%, resulting in a pressure of 96 kPa on the collection surface for ambient pressures of 101.3 kPa. The cut-point diameter (diameter of 50% collection efficiency) is at 0.13 μm for a sampling flow rate of 10 L min–1. After the collection step, aerosol particles are evaporated by he…

Carboxylic AcidsAnalytical chemistryAtmospheric-pressure chemical ionizationMass spectrometryMass SpectrometryOzoneHumansRelative humiditySpectroscopyBicyclic MonoterpenesAerosolsIonsChemical ionizationChromatographyTerpenesChemistryGeneral MedicineAtomic and Molecular Physics and OpticsAerosolAtmospheric PressureDeposition (aerosol physics)MonoterpenesAerosol mass spectrometryIon trapVolatilizationOxidation-ReductionEuropean Journal of Mass Spectrometry
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Highly Fluorescent and Water-Soluble Diketopyrrolopyrrole Dyes for Bioconjugation

2015

International audience; The preparation of highly water-soluble and strongly fluorescent diketopyrrolopyrrole (DPP) dyes using an unusual taurine-like sulfonated linker has been achieved. Exchanging a phenyl for a thienyl substituent shifts the emission wavelength to near λ=600 nm. The free carboxylic acid group present in these new derivatives was readily activated and the dyes were subsequently covalently linked to a model protein (bovine serum albumin; BSA). The bioconjugates were characterized by electronic absorption, fluorescence spectroscopy and MALDI-TOF mass spectrometry, thus enabling precise determination of the labeling density (ratio DPP/BSA about 3 to 8). Outstanding values of…

Carboxylic acid[SDV.NEU.NB]Life Sciences [q-bio]/Neurons and Cognition [q-bio.NC]/NeurobiologyFluorescent DyeQuantum yield[CHIM.THER]Chemical Sciences/Medicinal Chemistry010402 general chemistryPhotochemistryPyrrole01 natural sciencesFluorescence spectroscopyFluorescenceCatalysischemistry.chemical_compound[SDV.BC.IC]Life Sciences [q-bio]/Cellular Biology/Cell Behavior [q-bio.CB]Fluorescence microscopeMESH: WaterOrganic chemistryPyrrolesFluoresceinBovine serum albuminFluorescent Dyeschemistry.chemical_classificationBioconjugationbiology010405 organic chemistrySynthetic methodProteinChemistry (all)Dyes/pigmentWaterGeneral ChemistryGeneral MedicineMESH: Fluorescent DyesFluorescenceproteins0104 chemical sciencesimaging agentsMESH: SolubilitychemistrySolubilitybiology.proteinsynthetic methodsMESH: Pyrroles[SDV.SP.PHARMA]Life Sciences [q-bio]/Pharmaceutical sciences/Pharmacologydyes/pigmentsImaging agent
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Phylostratic Shift of Whole-Genome Duplications in Normal Mammalian Tissues towards Unicellularity Is Driven by Developmental Bivalent Genes and Reve…

2020

Tumours were recently revealed to undergo a phylostratic and phenotypic shift to unicellularity. As well, aggressive tumours are characterized by an increased proportion of polyploid cells. In order to investigate a possible shared causation of these two features, we performed a comparative phylostratigraphic analysis of ploidy-related genes, obtained from transcriptomic data for polyploid and diploid human and mouse tissues using pairwise cross-species transcriptome comparison and principal component analysis. Our results indicate that polyploidy shifts the evolutionary age balance of the expressed genes from the late metazoan phylostrata towards the upregulation of unicellular and early m…

CarcinogenesisCircadian clockAntineoplastic AgentsBiologyGenomeArticleCatalysisBivalent (genetics)Epigenesis Geneticlcsh:ChemistryProto-Oncogene Proteins c-mycInorganic ChemistryTranscriptomeMicePolyploidGene DuplicationNeoplasmsProtein Interaction MappingAnimalsHumanscancerEpigeneticsPhysical and Theoretical Chemistrylcsh:QH301-705.5Molecular BiologyGenepolyploidybivalent genesSpectroscopyGeneticsGenomePloidiesCircadian Rhythm Signaling Peptides and ProteinsOrganic Chemistryearly multicellularityviral-origin oncogenesOncogenesGeneral MedicineembryonalityPhenotypeNeoplasm ProteinsunicellularityComputer Science ApplicationsGene Expression Regulation Neoplasticlcsh:Biology (General)lcsh:QD1-999Drug Resistance NeoplasmMetabolic Networks and PathwaysInternational Journal of Molecular Sciences
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SGLT2 Inhibitors as the Most Promising Influencers on the Outcome of Non-Alcoholic Fatty Liver Disease

2022

Non-alcoholic fatty liver disease (NAFLD), the most frequent liver disease in the Western world, is a common hepatic manifestation of metabolic syndrome (MetS). A specific cure has not yet been identified, and its treatment is currently based on risk factor therapy. Given that the initial accumulation of triglycerides in the liver parenchyma, in the presence of inflammatory processes, mitochondrial dysfunction, lipotoxicity, glucotoxicity, and oxidative stress, can evolve into non-alcoholic steatohepatitis (NASH). The main goal is to identify the factors contributing to this evolution because, once established, untreated NASH can progress through fibrosis to cirrhosis and, ultimately, be co…

Carcinoma HepatocellularSettore MED/09 - Medicina Internatype 2 diabetes mellituSGLT2metabolic syndromeCatalysisInorganic ChemistryNon-alcoholic Fatty Liver DiseaseNAFLDAnimalsHumansHypoglycemic AgentsPhysical and Theoretical ChemistrySodium-Glucose Transporter 2 InhibitorsMolecular BiologySpectroscopyDipeptidyl-Peptidase IV InhibitorsHypoglycemic AgentLiver NeoplasmsOrganic Chemistrynutritional and metabolic diseasesGeneral Medicinedigestive system diseasesComputer Science ApplicationsGlucoseLiverDiabetes Mellitus Type 2HumanInternational Journal of Molecular Sciences
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Neuroinflammatory mechanisms in ischemic stroke: Focus on cardioembolic stroke, background, and therapeutic approaches

2020

One of the most important causes of neurological morbidity and mortality in the world is ischemic stroke. It can be a result of multiple events such as embolism with a cardiac origin, occlusion of small vessels in the brain, and atherosclerosis affecting the cerebral circulation. Increasing evidence shows the intricate function played by the immune system in the pathophysiological variations that take place after cerebral ischemic injury. Following the ischemic cerebral harm, we can observe consequent neuroinflammation that causes additional damage provoking the death of the cells; on the other hand, it also plays a beneficial role in stimulating remedial action. Immune mediators are the or…

Cardiac embolismNeuroimmunomodulationIschemiaInflammationReview030204 cardiovascular system & hematologyBioinformaticsCatalysisProinflammatory cytokineBrain IschemiaInorganic Chemistrylcsh:Chemistry03 medical and health sciencesCerebral circulation0302 clinical medicineImmune systemNeuroinflammationmedicineAnimalsHumansPhysical and Theoretical ChemistryMolecular Biologylcsh:QH301-705.5SpectroscopyNeuroinflammationInflammationEmbolic StrokeIschemic strokebusiness.industryOrganic ChemistryBrainGeneral Medicinemedicine.diseasePathophysiologyComputer Science ApplicationsStrokeEmbolismlcsh:Biology (General)lcsh:QD1-999Cytokinesmedicine.symptombusiness030217 neurology & neurosurgery
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2021

Growth and differentiation factor 15 (GDF15) belongs to the transforming growth factor-β (TGF-β) superfamily of proteins. Glial-derived neurotrophic factor (GDNF) family receptor α-like (GFRAL) is an endogenous receptor for GDF15 detected selectively in the brain. GDF15 is not normally expressed in the tissue but is prominently induced by “injury”. Serum levels of GDF15 are also increased by aging and in response to cellular stress and mitochondrial dysfunction. It acts as an inflammatory marker and plays a role in the pathogenesis of cardiovascular diseases, metabolic disorders, and neurodegenerative processes. Identified as a new heart-derived endocrine hormone that regulates body growth,…

Cardiac fibrosis030204 cardiovascular system & hematologyCatalysisInorganic Chemistry03 medical and health sciencesParacrine signalling0302 clinical medicineNeurotrophic factorsGlial cell line-derived neurotrophic factorMedicinePhysical and Theoretical ChemistryReceptorAutocrine signallingMolecular BiologySpectroscopy030304 developmental biology0303 health sciencesbiologybusiness.industryOrganic ChemistryGeneral Medicinemedicine.disease3. Good healthComputer Science Applicationsbiology.proteinCancer researchGDF15businessTransforming growth factorInternational Journal of Molecular Sciences
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Everything you wanted to know about phase and reference frequency in one- and two-dimensional NMR spectroscopy

2019

The fundamental concept of phase discussed in this tutorial aimed at providing students with an explanation of the delays and processing parameters they may find in nuclear magnetic resonance (NMR) pulse programs. We consider the phase of radio-frequency pulses, receiver, and magnetization and how all these parameters are related to phases and offsets of signals in spectra. The impact of the off-resonance effect on the phase of the magnetization is discussed before presenting an overview of how adjustment of the time reference of the free induction decay avoids first-order correction of the phase of spectra. The main objective of this tutorial is to show how the relative phase of a pulse an…

Carrier signalCarrier frequency010405 organic chemistryChemistryQuadratureTPPIGeneral ChemistryNuclear magnetic resonance spectroscopy010402 general chemistry01 natural sciencesSpectral line0104 chemical sciencesComputational physicsFOPAReference frequencyNMR spectra databaseFree induction decayMagnetizationNMR spectroscopyPhaseddc:540General Materials ScienceRelative phaseMagnetic Resonance in Chemistry
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