Search results for "CONSTANTS"
showing 10 items of 150 documents
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…
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…
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 …
Speciation of low molecular weight ligands in natural fluids: protonation constants and association of open chain polyamines with the major component…
2000
Abstract The interaction of five open chain polyamines (ethylenediamine (en), diethylenetriamine (dien), trietylenetetramine (trien), tetraethylenepentamine (tetren), spermine (sper)) with the major components of seawater was studied potentiometrically at 25°C, in an artificial seawater (containing Na+, K+, Mg2+, Ca2+, Cl− and SO42−) at different salinities (5–45‰). Potentiometric data were interpreted in terms of both the apparent protonation constants of polyamines and the formation constants of complexes formed by unprotonated or protonated amines and the cation and the anion of seawater (the inorganic content of seawater being considered as a single 1:1 salt). Some empirical relationshi…
Spectroscopic study of molecular associations between riboflavin and some (dihydro) β-carboline derivatives
1993
Abstract The spectrophotometric and thermodynamic properties of molecular complexes of riboflavin (RFN) with some dihydro β-carboline derivatives have been investigated by using electronic absorption and fluorescence spectroscopic methods in aqueous solution. The molecular associations have been examined by means of eletronic absorption spectra, since in each, a new charge transfer-like band has been located, and also by observing the variation of the fluorescence emission of RFN on the solutions. The formation constants for the molecular complexes were determined from absorption data, using the Forster—Hammick—Wardley method. The quenching phenomenon observed in RFN fluorescence is related…
A Theoretical Study of the Relationship between the Electrophilicity ω Index and Hammett Constant σp in [3+2] Cycloaddition Reactions of Aryl Azide/A…
2016
The relationship between the electrophilicity ω index and the Hammett constant σp has been studied for the [2+3] cycloaddition reactions of a series of para-substituted phenyl azides towards para-substituted phenyl alkynes. The electrophilicity ω index—a reactivity density functional theory (DFT) descriptor evaluated at the ground state of the molecules—shows a good linear relationship with the Hammett substituent constants σp. The theoretical scale of reactivity correctly explains the electrophilic activation/deactivation effects promoted by electron-withdrawing and electron-releasing substituents in both azide and alkyne components.
Double precision errors in the logistic map: statistical study and dynamical interpretation.
2007
The nature of the round-off errors that occur in the usual double precision computation of the logistic map is studied in detail. Different iterative regimes from the whole panoply of behaviors exhibited in the bifurcation diagram are examined, histograms of errors in trajectories given, and for the case of fully developed chaos an explicit formula is found. It is shown that the statistics of the largest double precision error as a function of the map parameter is characterized by jumps whose location is determined by certain boundary crossings in the bifurcation diagram. Both jumps and locations seem to present geometric convergence characterized by the two first Feigenbaum constants. Even…
Development of Polyamine‐Substituted Triphenylamine Ligands with High Affinity and Selectivity for G‐Quadruplex DNA
2019
Currently, significant efforts are devoted to designing small molecules able to bind selectively to guanine quadruplexes (G4s). These noncanonical DNA structures are implicated in various important biological processes and have been identified as potential targets for drug development. Previously, a series of triphenylamine (TPA)-based compounds, including macrocyclic polyamines, that displayed high affinity towards G4 DNA were reported. Following this initial work, herein a series of second-generation compounds, in which the central TPA has been functionalised with flexible and adaptive linear polyamines, are presented with the aim of maximising the selectivity towards G4 DNA. The acid-bas…
A Simple Apparatus for the Determination of the Optical Constants and the Thickness of Absorbing Thin Films
2001
We report on a simple and inexpensive apparatus useful for measuring the optical constants n, k and the thickness of weakly absorbing thin films. The measurement is based on an accurate determination of the reflectance and transmittance of a specimen illuminated by a laser beam. The laser beam is incident on a transparent substrate coated with the film to be evaluated, with an angle of incidence equal to the Brewster angle for the substrate, and its polarization can be switched between the p and s states. If the thickness is known to be within a presumptive range, measurements of the p and s reflectance and transmittance allow a calculation of the optical constants n, k and the thickness of…
Interactions of Dioxouranium(VI) with Amines in Aqueous Solution
2010
The interaction of the dioxouranium(VI) ion with five low molecular weight polyamines (ethylenediamine, putrescine, cadaverine, spermidine, and spermine) and with poly(allyl)amine (15 kDa) was studied potentiometrically (ISE-H + glass electrode) at T ) 298.15 K. Investigations were carried out in NaNO3 ionic medium, at I ) 0.1 mol · L -1 (and 0.5 mol · L -1 for poly(allyl)amine only), in the pH range 3.5 to 5.5, before the formation of uranyl insoluble species. The results gave evidence for the formation of two species, namely, UO2L 2+ and UO2L(OH) + for the diamine systems (ethylenediamine, putrescine, cadaverine), UO2L 2+ and UO2LH 3+ for spermidine, and UO2LH 3+ and UO2LH2 4+ for spermin…