The conductance behaviour of NaBPh4 in acetonitrile–toluene mixtures at 15,25, and 35 °C

1989 ◽  
Vol 67 (10) ◽  
pp. 1624-1627 ◽  
Author(s):  
N. Papadopoulos
Keyword(s):  
Experimental Data ◽  
Thermodynamic Parameters ◽  
Association Constant ◽  
Association Constants ◽  
Coulombic Interaction ◽  
Limiting Molar Conductances

The limiting molar conductances and association constants for NaBPh4 have been evaluated in acentonitrile–toluene mixtures at 15, 25, and 35 °C. Experimental data have been analysed by the Lee–Wheaton conductance equation. The thermodynamic parameters of the non-coulombic interaction have been evaluated. Keywords: conductance, association constant, Lee–Wheaton equation, acetonitrile–toulene.

The conductance behaviour of NaI and NaBPh4 in acetone and in isopropanol at 10, 15, 20, 25, and 30 °C

1989 ◽  
Vol 54 (6) ◽  
pp. 1475-1481 ◽  
Author(s):  
N. Papadopoulos ◽  
G. Ritzoulis
Keyword(s):  
Experimental Data ◽  
Thermodynamic Parameters ◽  
Coulombic Interaction

Molar conductivities at the limit of zero concentration have been evaluated for NaI and NaBPh4 in acetone and in isopropanol at 10, 15, 20, 25, and 30 °C. The experimental data have been analysed by means of the Lee-Wheaton equation. The thermodynamic parameters of the non-coulombic interaction have been evaluated.

scholarly journals Phase Relations in the ZrO2-MgO-FeOx System: Experimental Data and Assessment of Thermodynamic Parameters

2021 ◽  
Author(s):  
Ivan Saenko ◽  
O. Fabrichnaya
Keyword(s):  
Electron Microscopy ◽  
Experimental Data ◽  
Solid Solution ◽  
Thermodynamic Parameters ◽  
Spinel Phase ◽  
Experimental Investigations ◽  
X Ray ◽  
Heat Treated ◽  
Preliminary Phase ◽  
Scanning Electron

AbstractThermodynamic parameters were assessed for the MgO–FeOx system and combined with already available descriptions of ZrO2-FeOx and ZrO2-MgO systems to calculate preliminary phase diagrams for planning experimental investigations. Samples of selected compositions were heat treated at 1523, 1673 and 1873 K and characterized using x-ray and scanning electron microscopy combined with energy dispersive x-ray spectroscopy (SEM/EDX). Experiments indicated extension of cubic ZrO2 solid solution into the ternary system at 1873 K (75 mol.% ZrO2, 10 mol.% FeOx and 15 mol.% MgO) and limited solubility of 4 mol.% ZrO2 in spinel phase. Based on the obtained results thermodynamic parameters of C-ZrO2 and spinel phase were optimized.

scholarly journals Conductometric studies of 1, 3, 5 –triazinothiocarbamide at different concentration and temperature

2021 ◽  
Vol 16 (2) ◽  
pp. 151-157
Author(s):  
DD Sonone ◽  
ME Shelke ◽  
DT Tayade
Keyword(s):  
Thermodynamic Parameters ◽  
Association Constant ◽  
Ion Association ◽  
Vital Role ◽  
Ion Pair ◽  
Pair Formation ◽  
Drug Diffusion ◽  
Ion Pair Formation

Conductivity plays vital role in drug diffusion. Thermodynamic parameters affected by substituents of drug. Thermodynamic parameters of 1, 3, 5 –triazinothiocarbamide (1a) have been investigated by using conductometrically carried out at different molar concentrations. This work highlights investigation of G, K and µ values. The thermodynamic parameters viz. ΔH, ΔS and ∆G for ion pair formation determine from the value of ion association constant. This technique is suitable and accurate to study of pharmokinetics and pharmodynamics parameters.

scholarly journals Thermodynamic reassessment of the Mn-Ni-Si system

2015 ◽  
Vol 51 (2) ◽  
pp. 125-132 ◽  
Author(s):  
B. Hu ◽  
Y. Du ◽  
J.J. Yuan ◽  
Z.F. Liu ◽  
Q.P. Wang
Keyword(s):  
Experimental Data ◽  
Phase Diagram ◽  
Phase Diagrams ◽  
Thermodynamic Parameters ◽  
Ternary Phase ◽  
Sublattice Model ◽  
Diagram Approach ◽  
Measured Phase

Iased on the new experimental data available in the literature, the Mn-Ni-Si system has been reassessed using the CALPHAD (CALculation of PHAse Diagram) approach. Compared with the previous modeling, the ?8 and ?12 ternary phases were treated as the same phase according to the new experimental data. The Mn3Si phase was described with two sublattice model (Mn, Ni)3(Si)1. The reported new ternary phase ? was not considered in the present work. Comprehensive comparisons between the calculated and measured phase diagrams showed that a set of thermodynamic parameters of the Mn-Ni-Si system obtained in this work was more accurate than the previous one.

scholarly journals Study of a Conformational Equilibrium of Lisinopril by HPLC, NMR, and DFT

2014 ◽  
Vol 2014 ◽  
pp. 1-8 ◽  
Author(s):  
Sondes Bouabdallah ◽  
Med Thaieb Ben Dhia ◽  
Med Rida Driss
Keyword(s):  
Experimental Data ◽  
Thermodynamic Parameters ◽  
Conformational Equilibrium ◽  
Theoretical Calculations ◽  
Nmr Data ◽  
Major Species ◽  
B3lyp Calculations

The isomerization of lisinopril has been investigated using chromatographic, NMR spectroscopic, and theoretical calculations. The NMR data, particularly the NOEDIFF experiments, show that the major species that was eluted first is thetransform. The proportion was 77% and 23% for thetransandcis, respectively. The thermodynamic parameters (ΔH,ΔS, andΔG) were determined by varying the temperature in the NMR experiments. The interpretations of the experimental data were further supported by DFT/B3LYP calculations.

Water Proton Relaxation Rate Enhancements and Association Constants for Mn(II) to Serum Proteins Determined by NMR T1 Measurements

2005 ◽  
Vol 60 (9-10) ◽  
pp. 807-812 ◽  
Author(s):  
Hatice Budak
Keyword(s):  
Serum Albumin ◽  
Human Serum ◽  
Relaxation Rate ◽  
Association Constant ◽  
Serum Proteins ◽  
Association Constants ◽  
Water Proton ◽  
Proton Relaxation ◽  
Rate Enhancement ◽  
Human Serum Proteins

Abstract The water proton relaxation rate enhancement of Mn(II) bound to bovine serum albumin (BSA) and the association constant for manganese to BSA have already been determined, but such determinations have not been done for human serum albumin (HSA) and other human serum proteins and also for human serum. In this work, NMR T1 values in aqueous solutions of serum proteins and serum were measured versus increasing concentration of Mn(II). Proton relaxation rate enhancements (ε*) caused by different manganese concentrations were determined for each solution and 1/ε* was fitted against concentrations of Mn(II). Proton relaxation rate enhancements (εb) of Mn(II) bound to albumin, γ-globulin, (α+β)- globulins and serum were found to be 13.69, 3.09, 8.62, and 10.87, respectively. Free and bound manganese fractions, resulted from each addition of Mn(II) to the sample, were determined by using corresponding (ε*) and the εb values. Association constants for Mn(II) to HSA and γ-globulin were calculated as 1.84 x 104 ᴍ-1 and 2.35 x 104 ᴍ-1, respectively. Present data suggest that the proton relaxation rate enhancement of Mn(II) in serum is caused by Mn(II) bound to various serum constituents. Data also suggest that association constants for Mn(II) to γ-globulin are nearly the same as that to HSA.

Hydrolysis of aryl hydrogen maleate esters mediated by cyclodextrins — Effect on the intramolecular catalysis

2005 ◽  
Vol 83 (9) ◽  
pp. 1281-1286 ◽  
Author(s):  
Gabriel O Andrés ◽  
O Fernando Silva ◽  
Rita H de Rossi
Keyword(s):  
Maleic Anhydride ◽  
Transition State ◽  
Rate Constant ◽  
Association Constant ◽  
Kinetic Studies ◽  
Association Constants ◽  
Bulk Solution ◽  
Intramolecular Catalysis ◽  
Hydrolysis Of ◽  
Nonlinear Fashion

Kinetic studies of the hydrolysis of Z-aryl hydrogen maleates (Z = H, p-CH3, m-CH3, p-Cl, m-Cl) were carried out in the presence and absence of hydroxypropyl-β-cyclodextrin (HPCD) at variable pH from 1.00 to 3.00. The reaction involves the formation of maleic anhydride as an intermediate and the rate of its formation is strongly dependent on the pH. This is because the neighboring carboxylate group is a better catalyst than the carboxylic group. The rate constant for the formation of maleic anhydride decreases as the HPCD concentration increases in a nonlinear fashion. The results were interpreted in terms of the formation of a 1:1 inclusion complex of the esters with HPCD. The neutral (HA) and anionic (A) species of the substrate have different association constants (K[Formula: see text] and K[Formula: see text]). In all cases studied, K[Formula: see text] is higher than K[Formula: see text] for the same substrate. This difference is responsible for a decrease in the amount of the anionic substrate (reactive species) in the presence of HPCD, which results in a diminution of the observed rate constant. Besides, the rate constant for the reaction of the complexed substrate is smaller than that in the bulk solution indicating that the transition state of the cyclodextrin mediated reaction is less stabilized than the anionic substrate. The values of ΔΔG‡ are almost independent of the substituent on the aryl ring and range within 0.48 and 1.05 kcal mol–1 (1 cal = 4.184 J). There is no correlation between KTS and the association constant of the substrate indicating that the factors stabilizing the transition state are different from those that stabilize the substrate. Key words: cyclodextrins, intramolecular catalysis, hydrolysis, inhibition.

Insights into cationic methyl violet 6B dye–kaolinite interactions: kinetic, equilibrium and thermodynamic studies

Clay Minerals ◽  
2013 ◽  
Vol 48 (1) ◽  
pp. 85-95 ◽  
Author(s):  
İ. Sargin ◽  
N. Ünlü
Keyword(s):  
Experimental Data ◽  
Ionic Strength ◽  
Adsorption Capacity ◽  
Thermodynamic Parameters ◽  
Adsorption Kinetics ◽  
Adsorption Process ◽  
Methyl Violet ◽  
Order Type ◽  
Kinetic And Thermodynamic Parameters ◽  
Initial Ph

AbstractIn this study, adsorption and adsorption kinetics of methyl violet dye from aqueous solutions onto kaolinite were investigated. The effects of adsorbent dosage, pH, ionic strength, contact time, temperature and initial dye concentration were studied. Kinetic and thermodynamic parameters were determined using experimental data. Adsorption capacity decreased with increasing ionic strength. Changes in the initial pH of the dye solution in a range close to the dye's natural pH (i.e. ∼ pH 5.0) values affected adsorption capacity slightly, indicating that adsorption studies could be carried out at the dye's natural pH. The adsorption process followed the Freundlich-type adsorption isotherms and pseudo-second order type adsorption kinetics. However, an intraparticle diffusion process was found to have effects in adsorption processes. Thermodynamic parameters were calculated from the experimental data and enthalpy of the adsorption, ΔH0, was found to be –6.82 kJ mol–1, indicating physisorption nature of the adsorption. Other thermodynamic parameters, ΔS0 and DG0, were also calculated. Negative values of ΔG0 indicated that the adsorption process for methyl violet on kaolinite is spontaneous.

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