Search results for "MR"

showing 10 items of 3001 documents

Complexes of tryptophan dipeptides with the R2Sn(IV)2+ ion (R=Me, Ph): Spectroscopic studies, solution properties and structural implications

1995

Tryptophan dipeptides such as L-tryptophyl-L-alanine (H 2 TrpAla), L-tryptophyl-L-tyrosine (H 2 TrpTyr), L-tryptophyl-L-tryptophan (H 2 TrpTrp), along with L-histidyl-L-tyrosine (H 2 HisTyr), were reacted with R 2 SnO (R=Me, Ph) yielding the corresponding complexes. The complexes have been characterized by IR and 119 Sn Mossbauer spectroscopy in the solid state and by 1 H and 13 C NMR in CD 3 OD solutions. Monomeric species were detected, with the tin atom arranged in a pentacoordinated trigonal-bipyramidal structure. The dipeptides are coordinated via the terminal amino group, deprotonated peptide nitrogen and terminal carboxylate group. No side-chain appears to be involved in bonding. Det…

chemistry.chemical_classificationDipeptideChemistryStereochemistryTryptophanPeptideGeneral ChemistryNuclear magnetic resonance spectroscopyCarbon-13 NMRInorganic ChemistryCrystallographychemistry.chemical_compoundDeprotonationCarboxylateConformational isomerismApplied Organometallic Chemistry
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On the behaviour of the (Z)-Phenylhydrazones of some 5-alkyl-3-benzoyl-1,2,4-oxadiazoles in solution and in the gas phase: kinetic and spectrometric …

2008

Abstract Rate constants, k A,R , for the rearrangement of the ( Z )-phenylhydrazones ( 1a – e ) of a series of 5-alkyl-3-benzoyl-1,2,4-oxadiazoles substituted at C(5) with linear alkyl chains of different length (from C 4 up to C 12 ) into the relevant 4-acylamino-2,5-diphenyl-1,2,3-triazoles ( 2a – e ) have been measured in dioxan/water in the base-catalyzed region (pS + 10.5–12.6). For each substrate log  k A,R are linearly related to pS + . The significant decrease of the slopes of these straight lines (from 0.96 down to 0.78) upon increasing the length of the linear alkyl chain at C(5) and that of the reactivity (down to 14–26%) upon increasing the substrate concentration suggest a decr…

chemistry.chemical_classificationDirect evidenceStereochemistryOrganic ChemistrySubstrate (chemistry)124-oxadiazoleKinetic energyBiochemistryCrystallographyReaction rate constantchemistryDrug DiscoveryProton NMRReactivity (chemistry)Self-assemblymononuclear rearrangementAlkyl
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Structure and properties of N-methyl-N-(4-pyridyl)-nitramine and 1,4-dihydro-1-methyl-4-nitriminopyridine

2002

Abstract The molecular structure and spectral properties of N -methyl- N -(4-pyridyl)-nitramine ( 1 ) and 1,4-dihydro-1-methyl-4-nitriminopyridine ( 3 ) were investigated by the X-ray diffraction, FTIR, nuclear magnetic resonance (NMR) methods and DFT theoretical calculations. N -methyl- N -(4-pyridyl)-nitramine ( 1 ) crystallises in the orthorhombic Pbca space group. It is composed of two planar fragments; nitramino (N 2 O 2 ) group and the pirydyl ring. These two groups are twisted at about 70° with respect to each other, along the Ar–N bond. On the contrary, in compound 3 , they are coplanar to each other. Twist of the nitramino group in 1 with respect to the pirydyl ring leads to a sign…

chemistry.chemical_classificationDouble bondChemistryStereochemistryNMR spectraOrganic ChemistryCarbon-13 NMRRing (chemistry)DFT calculationsAnalytical ChemistryInorganic ChemistryBond lengthNMR spectra databaseCrystallographychemistry.chemical_compoundFTIR spectraPyridineMoleculeOrthorhombic crystal systemX-ray structureN-Nitro compoundsSpectroscopyJournal of Molecular Structure
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Interaction Mechanisms between guaiacols and lignin: the conjugated double bond makes the difference.

2011

Lignin is considered to be responsible for a selective sorption of phenolic compounds on wood. In order to investigate the mechanisms involved, two similar guaiacol compounds--only differing by the nature of the para side chain--were adsorbed on oak wood extracted lignin. Vapor sorption-desorption isotherms indicated that about 3.5 wt % of 4-vinylguaiacol is adsorbed near saturation whereas it is only 0.8% for 4-ethylguaiacol. For both compounds, the isotherms displayed a hysteresis though significantly greater for 4-vinylguaiacol. Analyses of the hydroxyl stretching region of FTIR spectra of the lignin/4-ethylguaiacol and lignin/4-vinylguaiacol complexes indicated that physisorption via hy…

chemistry.chemical_classificationDouble bondHydrogen bondChemistrytechnology industry and agriculturemacromolecular substancesSurfaces and InterfacesConjugated systemCondensed Matter Physicscomplex mixturesNMR spectra databasechemistry.chemical_compoundPhysisorptionDesorptionElectrochemistryLigninOrganic chemistryGeneral Materials ScienceGuaiacolSpectroscopyLangmuir : the ACS journal of surfaces and colloids
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Encapsulation of secondary and tertiary ammonium salts by resorcinarenes and pyrogallarenes: the effect of size and charge concentration

2015

The binding of different categories of alkyl ammonium (secondary and tertiary mono- and di-ammonium) salts with resorcinarenes and a pyrogallarene through weak interactions was analysed in all phases. 1H NMR spectroscopy and electrospray ionisation mass spectrometry were utilized in analysing the complexes in solution and in the gas phase, respectively. The 1H NMR titration studies in methanol-d4 reveal that the association constants for the 1:1 complexes vary according to the electronic properties of the hosts as well as the size, geometric orientation and charge concentration of the guest cations with binding constants of up to 950 M−1 in some cases. Mass spectrometry reveals 1:1 monomeri…

chemistry.chemical_classificationElectrosprayHydrogen bondAnalytical chemistryammonium saltsGeneral ChemistryCrystal structureCondensed Matter PhysicsMass spectrometrychemistrychemistry.chemical_compoundCrystallographyMonomerchemistryProton NMRGeneral Materials ScienceTitrationta116AlkylCrystEngComm
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Synthesis of low density poly(ethylene) using nickel iminophosphonamide complexes

2007

Ethylene polymerization using a catalyst derived from the reaction of the phosphorane (Me3Si)2NP(NSiMe3)2 (1) with either Ni(COD)2 or bis(π-allyl)Ni complexes affords branched poly(ethylene) (PE) of variable MW (103−106) depending on conditions. The branched PE of high MW is semicrystalline with Tm < 100 °C. High field 13C NMR spectra reveal the presence of methyl branches (ca. 10−15 per 1000 C atoms), branches longer than six C atoms (15−20 per 1000 C atoms) and trace levels of ethyl, propyl, n-butyl, and sec-butyl branches (total <2 per 1000 C atoms). The branching distribution changes modestly in response to changes in ethylene pressure in a manner consistent with a chain-walking mechani…

chemistry.chemical_classificationEthylenePolymers and PlasticsStereochemistryOrganic ChemistryPolymerCarbon-13 NMRBranching (polymer chemistry)PhosphoraneInorganic Chemistrychemistry.chemical_compoundCrystallographyCrystallinitychemistryPolymerizationMaterials ChemistryMoleculeMacromolecules
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RNA-controlled nucleocytoplasmic shuttling of mRNA decay factors regulates mRNA synthesis and initiates a novel mRNA decay pathway

2021

AbstractmRNA level is controlled by factors that mediate both mRNA synthesis and decay, including the exonuclease Xrn1 - a major mRNA synthesis and decay factor. Here we show that nucleocytoplasmic shuttling of Xrn1 and of some of its associated mRNA decay factors plays a key role in determining both mRNA synthesis and decay. Shuttling is regulated by RNA-controlled binding of the karyopherin Kap120 to two nuclear localization sequences (NLSs) in Xrn1. The decaying RNA binds and masks NLS1, establishing a link between mRNA decay and Xrn1 shuttling. Mutations in the two NLSs, which prevent Xrn1 import, compromise transcription and, unexpectedly, also the cytoplasmic decay of ∼50% of the cell…

chemistry.chemical_classificationExonuclease0303 health sciencesbiology030302 biochemistry & molecular biologyMRNA DecayRNACell biology03 medical and health sciencesmedicine.anatomical_structurechemistryCytoplasmTranscription (biology)medicinebiology.proteinNucleusNuclear localization sequence030304 developmental biologyKaryopherin
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Advanced CPMAS-13C NMR techniques for molecular characterization of size-separated fractions from a soil humic acid

2006

A humic acid extracted from a volcanic soil was subjected to preparative high-performance size-exclusion chromatography (HPSEC) to reduce its molecular complexity and eleven different size fractions were obtained. Cross-polarization magic-angle spinning 13C NMR (CPMAS 13C NMR) analysis performed with variable contact-time (VCT) pulse sequences showed that the largest molecular-size fractions contained aromatic, alkyl, and carbohydrate-like components. The carbohydrate-like content and the alkyl chain length seemed to decrease with decreasing molecular size. Progressive reduction of aromatic carbon atoms was also observed with decreasing molecular size of the separated fractions. Mathematica…

chemistry.chemical_classificationGel permeation chromatographyMagic angleProtonchemistryContent (measure theory)Relaxation (NMR)Analytical chemistryHumic acidCarbon-13 NMRBiochemistryAlkylAnalytical ChemistryAnalytical and Bioanalytical Chemistry
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Rheological study of gel phenomena during epoxide network formation in the presence of sepiolite

2012

The dynamic behaviour during the crosslinking of an epoxy polymer near the gel point was monitored using rheological multiple frequency experiments. The influence of a needle-shaped inorganic nanofiller, sepiolite, either non-modified or organically surface modified during the cure process in the presence of an aliphatic and an aromatic hardener was investigated. The validity of various criteria for determining the gel point was examined for the crosslinking of these filled thermosets. The Winter–Chambon criterion at the gel point is obeyed by the unfilled and by the non-modified sepiolite-filled epoxy matrix with either of the two hardeners. However, physical gels are formed in the presenc…

chemistry.chemical_classificationGel pointMaterials sciencePolymers and PlasticsSepioliteOrganic ChemistryRelaxation (NMR)EpoxideThermosetting polymerEpoxyPolymerchemistry.chemical_compoundchemistryRheologyvisual_artMaterials Chemistryvisual_art.visual_art_mediumComposite materialPolymer International
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An Au(iii)–amino alcohol complex for degradation of organophosphorus pesticides

2015

An Au(III)–amino alcohol complex has been used to cleave organophosphorous pesticides of the dithiophosphate family. P–S bond breaking was readily demonstrated by 1H NMR, 31P NMR and MS. Thiol fragment release was also demonstrated using 2,4-dinitrobenzenesulfonyl fluorescein ethyl ester as a fluorescent sensor.

chemistry.chemical_classificationGeneral Chemical EngineeringAlcoholGeneral ChemistryFluorescenceMedicinal chemistrychemistry.chemical_compoundchemistryCleaveThiolProton NMROrganic chemistryDegradation (geology)FluoresceinOrganophosphorus pesticidesRSC Advances
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