Search results for "Stability constants"

showing 10 items of 78 documents

Oxoanion binding to a cyclic pseudopeptide containing 1,4-disubstituted 1,2,3-triazole moieties

2016

A macrocyclic pseudopeptide 3 is described featuring three amide groups and three 1,4-disubstituted 1,2,3-triazole units along the ring. This pseudopeptide was designed such that the amide NH groups and the triazole CH groups converge toward the cavity, thus creating an environment well suited for anion recognition. Conformational studies in solution combined with X-ray crystallography confirmed this preorganisation. Solubility of 3 restricted binding studies to organic media such as 5 vol% DMSO/acetone or DMSO/water mixtures with a water content up to 5 vol%. These binding studies demonstrated that 3 binds to a variety of inorganic anions in DMSO/acetone including chloride, nitrate, sulfat…

010405 organic chemistryChemistryStereochemistryDimerOrganic ChemistryTriazoleoxoanion bindings010402 general chemistry01 natural sciencesBiochemistryChlorideMedicinal chemistry0104 chemical scienceschemistry.chemical_compoundpseudopeptidesStability constants of complexesAmidemedicineMoleculePhysical and Theoretical ChemistrySulfateSolubilityta116medicine.drugOrganic & Biomolecular Chemistry
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Solubility and acid-base properties and activity coefficients of chitosan in different ionic media and at different ionic strengths, at T=25°C

2009

Studies on the acid-base properties and solubility of a polyammonium polyelectrolyte (chitosan) with different molecular weights (MW 310 and 50 kDa), were performed at T=25 °C, in the pH range 2.5–7. The protonation of chitosan was investigated by potentiometry ([H+]-glass electrode) in NaCl, NaNO3 and mixed NaNO3+Na2SO4 ionic media, at different ionic strengths. Protonation constants were calculated as a function of dissociation degree α by means of two different models, namely, a simple linear model and the modified Henderson–Hasselbalch equation. Experimental data were also fitted using a model independent of α (Diprotic-like model), according to which the acid-base properties can be sim…

Activity coefficientChemistryInorganic chemistryIonic bondingProtonationChitosan Acid-base properties Solubility Activity coefficients Ion pair formationCondensed Matter PhysicsSettore CHIM/12 - Chimica Dell'Ambiente E Dei Beni CulturaliAtomic and Molecular Physics and OpticsDissociation (chemistry)Electronic Optical and Magnetic MaterialsSpecific ion interaction theoryIonic strengthStability constants of complexesMaterials ChemistrySettore CHIM/01 - Chimica AnaliticaPhysical and Theoretical ChemistrySolubilitySpectroscopyJournal of Molecular Liquids
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Polyfunctional recognition of pyridinedicarboxylate anions with macrocyclic polyamine receptors containing heteroaromatic groups.

2008

The interaction of the biologically relevant anions deriving from the six pyridinedicarboxylic acids (H2PDC) with two macrocyclic receptors containing a pentamine chain and a bipyridine (1) or a phenanthroline (2) moiety, as well as with the aliphatic analogue [21]aneN7 (3), was studied by means of spectroscopic methods (UV-vis, NMR) and potentiometric titrations affording the stability constants of the adducts formed. All three receptors form stable complexes with the substrates thanks to the formation of several salt bridges and hydrogen bond contacts, as observed in the crystal structure of the H8[3(2,6-PDC)4] x H2O x 0.5 EtOH solid compound. Additional pi-stacking interactions between t…

AnionsModels MolecularMacrocyclic CompoundsStereochemistryPyridinesPhenanthrolineStatic ElectricityCarboxylic AcidsHydrocarbons Aromaticchemistry.chemical_compoundBipyridineMolecular recognitionPolymer chemistryPolyaminesMoietychemistry.chemical_classificationBinding SitesHydrogen bondSpectrum AnalysisOrganic ChemistryHydrogen BondingDicarboxylic acidchemistryStability constants of complexesPotentiometryAliphatic compoundThe Journal of organic chemistry
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The interaction of amino acids with the major constituents of natural waters at different ionic strengths

2000

Abstract The interaction of amino acids with the major constituents of natural waters has been studied potentiometrically by determining protonation constants at different ionic strengths (e.g., I ≤5.6 mol (kg H 2 O) −1 (NaCl)) and in artificial seawater (containing Na + , K + , Ca 2+ , Mg 2+ , Cl − and SO 4 2− ) at different salinities. For glycine determinations in mixed NaCl–MgCl 2 , electrolyte solutions were also performed. The data included in this work, together with some already published, make it possible to calculate parameters for dependence on ionic strength using different models, i.e. an extended Debye–Huckel type equation and Pitzer equations. The results can be interpreted b…

Aqueous solutionChemistryInorganic chemistryIonic bondingArtificial seawaterProtonationGeneral ChemistryOceanographyIonic strengthStability constants of complexesEnvironmental ChemistryPitzer equationsSeawaterWater Science and Technology
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Complexation of the potassium ion by diaza crown compounds in aqueous solutions

1988

The conductance behavior of potassium nitrate in water with and without 1,7,10,16-tetraoxa-4,13-diazacyclooctandecane[2.2] and 4,7,13,16,21,24-hexaoxa-1,10-diazabicyclo-8.8.8-exacosane[2.2.2] macrocyclic ligands have been studied in order to analyze the complexation behavior of potassium cations in water. The absence of the complexation found in the [2.2] system is discussed in terms of the ligand structural features (presence of hydrogen bond donor and acceptor sites). The ion pair association constant of potassium cryptate as obtained from conductance measurements is also reported and discussed.

Aqueous solutionChemistryLigandHydrogen bondPotassiumInorganic chemistryBiophysicsConductancechemistry.chemical_elementPotassium nitrateBiochemistryCrown Compoundschemistry.chemical_compoundStability constants of complexesPhysical and Theoretical ChemistryMolecular BiologyJournal of Solution Chemistry
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Violurato complexes of nickel(II). Formation equilibria. Deprotonation equilibria of the coordinated ligands and related stereochemical changes

1986

The formation equilibria of nickel(II) violurato-complexes in water and dimethylsulphoxide-water (80∶20) as well as deprotonation of the coordinated ligands and related stereochemical changes are reported. The stability constants of the Ni2+-H2V− complexes logβ1=5.06, Iogβ2=9.38, logβ3=12.98 as well as the acidity constants of the [Ni(H2V)3]− complex, logβj1= 8.37, logβj2=15.76, logβj3=22.37 are determined at 25 °C and 0.1M NaClO4. A new violurato-complex of Ni2+, Na4[Ni(HV)3]5H2O, is isolated and characterized.

Aqueous solutionChemistryStereochemistryOrganic solventMetals and Alloyschemistry.chemical_elementMedicinal chemistryCatalysisInorganic ChemistryNickelchemistry.chemical_compoundDeprotonationStability constants of complexesMaterials ChemistryHydrateOrganometallic chemistryTransition Metal Chemistry
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Sequestration of organometallic compounds by natural organic matter. binding of trimethyltin(IV) by fulvic and alginic acids

2006

The binding capacity of fulvic and alginic acids towards trimethyl tin(IV) cation was quantitatively determined in order to evaluate the sequestering ability of toxic organometallic compounds by natural organic matter. Investigations were performed in the pH range of natural waters (5–8.5) where the carboxylate groups, largely present in both sequestering agents, are the main binding sites. A chemical interaction model, according to which both the protonation of polyelectrolyte ligands and the hydrolysis of the organotin cation in NaCl aqueous solution were considered, was used to define the speciation of the systems under investigation. Measurements performed at different ionic strength va…

Aqueous solutionChemistrycomplexationInorganic chemistrysequestrationProtonationGeneral ChemistryPolyelectrolyteInorganic ChemistryHydrolysischemistry.chemical_compoundspeciationIonic strengthStability constants of complexesSettore CHIM/01 - Chimica AnaliticaCarboxylatenatural organic matterorganometallic compoundhuman activitiesAlginic acidApplied Organometallic Chemistry
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Thermodynamic parameters for the formation of glycine complexes with magnesium(II), calcium(II), lead(II), manganese(II), cobalt(II), nickel(II), zin…

1995

Abstract Protonation constants and Mg 2+ , Ca 2+ , Pb 2+ , Mn 2+ -, Co 2+ , Ni 2+ , Cu 2+ , Zn 2+  and Cd 2+ glycine complex formation constants have been determined in different aqueous media at different temperatures. Salt effects are explained by a complex formation model which takes into account the formation of weak species. From the temperature dependence of the formation constants, thermodynamic parameters ΔH θ (and in some cases ΔC θ p ) have been obtained. A rigorous analysis of literature data, together with experimental findings, allows recommended formation parameters, in the ranges 0 ≤ I e ≤ 1 mol l −1 ( I e is the effective ionic strength) and 5°C ≤ T ≤ 45°C, to be obt…

Aqueous solutionEnthalpyInorganic chemistrychemistry.chemical_elementIonic bondingProtonationManganeseCondensed Matter PhysicsNickelchemistryStability constants of complexesIonic strengthPhysical chemistryPhysical and Theoretical ChemistryInstrumentationThermochimica Acta
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Compounds of tungsten(VI) with citric acid: A spectrophotometric, polarimetric and hydrogen-1, carbon-13 N.M.R. study of the formation and interconve…

1986

Tungsten(VI)-citrate complexes, which occur in aqueous solution, were studied by polarimetric and absorbance measurements. The pH of the medium is the principal variable controlling complex formation and interconversion equilibria. At high pH (>6), the stable complexes are monomers with 1∶2 and 1∶1 stoichiometry, depending on the tungsten(VI)-citrate ratio, while at lower pH two different dinuclear complexes are formed. The intervals of existence of these species with the pH, the number of equivalents of acid necessary for their formation, as well as the conditional stability constant, have also been calculated. The structure of these compounds have been investigated by1H and13C-n.m.r. spec…

Aqueous solutionInorganic chemistryMetals and Alloyschemistry.chemical_elementTungstenOxygenCatalysisInorganic Chemistrychemistry.chemical_compoundchemistryStability constants of complexesMaterials ChemistryMoleculeStoichiometryOrganometallic chemistryTransition Metal Chemistry
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Complex formation equilibria between the acetazolamide ((5-acetamido-1,3,4-thiadiazole)-2-sulphonamide), a potent inhibitor of carbonicanhydrase, and…

1990

Abstract The stability constants for the equilibrium of complexation between acetazolamide and the divalent metal ions copper(II), nickel(II), zinc(II), and cobalt(II) have been determined by potentiometry both in water and in water-ethanol 50 vol. % solutions in 0.15 mol dm −3 NaNO 3 at 25°C. This mixed solvent has been used in order to obtain higher concentrations of acetazolamide in solution. For copper(II) and nickel(II), the binuclear species [Cu 2 (Acm) 2 ] and [Ni 2 (Acm) 3 ] 2− are detected in both solvents together with hydroxo species. The values of the stability constants are always higher in the mixed solvent than in water. For cobalt(II) and zinc(II), while in aqueous solution …

Aqueous solutionMetal ions in aqueous solutionInorganic chemistrychemistry.chemical_elementZincBiochemistryCopperInorganic ChemistryNickelchemistryStability constants of complexesChemical stabilityCobaltNuclear chemistryJournal of Inorganic Biochemistry
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