• Title/Summary/Keyword: Equilibrium constants

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Thermodynamic Investigation of the Formation of Complexes between Norfloxacin and Various Mononucleotides

  • Kwon, Yong-Jun;Lee, Hyun-Mee;Han, Sung-Wook;Lee, Dong-Jin;Cho, Tae-Sub
    • Bulletin of the Korean Chemical Society
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    • v.32 no.9
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    • pp.3233-3238
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    • 2011
  • The fluorescence of norfloxacin was quenched by various nucleotides. The ratio of the fluorescence intensities in the absence and presence of nucleotide was linearly dependent on nucleotide concentration, suggesting that quenching occurred through the formation of nonfluorescent norfloxacin-nucleotide complexes. The gradient of the linear relationship represented the equilibrium constant of complex formation; it decreased with increasing temperature. The slopes of van't Hoff plots constructed from the temperature-dependent equilibrium constants were positive in all cases, indicating that complex formation was energetically favorable - i.e., exothermic, with negative Gibb's free energy. The equilibrium constant increased when triphosphate was used instead of monophosphate. It also increased when the oxygen at the $C'_2$ position of the nucleotide was removed. Both enhancements were due to entropic effects: entropy decreased when complexes with AMP or GMP formed, while it increased when norfloxacin complexed with ATP, GTP, dAMP and dGMP.

ESTIMATION OF RAIN SCAVENGING RATIO FOR PARTICLE BOUND POLYCYCLIC AROMATIC HYDROCARBONS AND POLYCHLORINATED BIPHENYLS

  • Kim, Hyeon-Kook;Shin, Yong-Seung;Lee, Dong-Soo;Song, Byung-Joo;Kim, Jong-Guk
    • Environmental Engineering Research
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    • v.11 no.1
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    • pp.33-44
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    • 2006
  • The objective of this study was to develop and assess a method for estimating the rain scavenging ratios (RSRs) of particle-bound PAHs and PCBs using measured scavenging ratio of particulate matters (PM) and routinely available data of physico-chemical properties of PM. Paired atmospheric and rainwater sampling was conducted for a total of 4 rain events. Assuming equilibrium partitioning in rainwater-gas-PM system, an equation was derived for estimating the RSR of particle-bound chemicals as a function of RSR of PM and three equilibrium partition constants (i.e. dimensionless Henry's law constant, gas-particle partition coefficient, and water-particle partition coefficient). For all PAHs, the model significantly under-predicted the RSR while the model prediction for PCBs agreed with observation mostly within a factor of 5. The RSR model for the chemicals is of limited use as its accuracy critically depends on how close the observed partitioning of the chemicals in the gas-PM-rainwater system is to that estimated under the equilibrium assumption.

Simulation model at continuous steel-making process (연속제강공정의 simulation model)

  • Moon, Il;Song, Hyung-Keun;Shim, Jae-Dong
    • 제어로봇시스템학회:학술대회논문집
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    • 1986.10a
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    • pp.474-478
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    • 1986
  • The phenomenon of a continuous Steel-making process was studied with a set of collected equilibrium data for the steel-oxidation reactions. Mass and Heat balances were also established. Mass transfer constants which are physically unmeasurable but escential for the simulation study in the steel-making process were calculated from the experimental data using an optimization technique. Based on these data various operating conditions and process characteristics were examined.

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ON COMPLEX VARIABLE METHOD IN FINITE ELASTICITY

  • Akinola, Ade
    • Journal of applied mathematics & informatics
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    • v.12 no.1_2
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    • pp.183-198
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    • 2003
  • We highlight the alternative presentation of the Cauchy-Riemann conditions for the analyticity of a complex variable function and consider plane equilibrium problem for an elastic transversely isotropic layer, in finite deformation. We state the fundamental problems and consider traction boundary value problem, as an example of fundamental problem-one. A simple solution of“Lame's problem”for an infinite layer is obtained. The profile of the deformed contour is given; and this depends on the order of the term used in the power series specification for the complex potential and on the material constants of the medium.

Synergistic Extraction of Palladium(Ⅱ) with Thenoyltrifloroacetone and Tri-n-octylphosphine Oxide

  • 이상호;정구순
    • Bulletin of the Korean Chemical Society
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    • v.16 no.6
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    • pp.479-483
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    • 1995
  • The synergistic extraction of palladium(Ⅱ) was studied with 1,2-dichloroethane containing thenoyltrifluoroacetone (TTA; HA) and tri-n-octylphosphine oxide (TOPO; S). The main composition of synergistic adduct extracted into 1,2-dichloroethane phase was found to be PdA2S2. The equilibrium constants of the synergistic reaction were calculated. The application of this method to synthetic mixture for the separation of Pd from Pt was developed.

Kinetics and Equilibrium Study on β-glucosidase under High Hydrostatic Pressure (고압에서 β-glucosidase 반응속도론 및 평형에 관한 연구)

  • Han, Jin Young;Lee, Seung Ju
    • Food Engineering Progress
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    • v.15 no.3
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    • pp.214-220
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    • 2011
  • $\beta$-Glucosidase enzyme reaction under high hydrostatic pressure was investigated in terms of physical chemistry. A model substrate (p-nitrophenyl-${\beta}$-D-glucopyranoside(pNPG)) was used, and the pressure effects on the enzymatic hydrolysis (pNPG${\rightarrow}$pNP) at 25 MPa, 50 MPa, 75 MPa, and 100 MPa were analyzed. Two parts of the reaction such as kinetic and equilibrium stages were considered for mathematical modelling, and their physicochemical parameters such as forward and inverse reaction constants, equilibrium constant, volume change by pressure, etc. were mathematically modeled. The product concentration increased with pressure, and the two stages of reaction were observed. Prediction models were derived to numerically compute the product concentrations according to reaction time over kinetic to equilibrium stages under high pressure condition. Conclusively, the $\beta$-Glucosidase enzyme reaction could be activated by pressurization within 100 MPa, and the developed models were very successful in their prediction.

Review on the Determination of Frumkin, Langmuir, and Temkin Adsorption Isotherms at Electrode/Solution Interfaces Using the Phase-Shift Method and Correlation Constants

  • Chun, Jinyoung;Chun, Jang H.
    • Korean Chemical Engineering Research
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    • v.54 no.6
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    • pp.734-745
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    • 2016
  • This review article described the electrochemical Frumkin, Langmuir, and Temkin adsorption isotherms of over-potentially deposited hydrogen (OPD H) and deuterium (OPD D) for the cathodic $H_2$ and $D_2$ evolution reactions (HER, DER) at Pt, Ir, Pt-Ir alloy, Pd, Au, and Re/normal ($H_2O$) and heavy water ($D_2O$) solution interfaces. The Frumkin, Langmuir, and Temkin adsorption isotherms of intermediates (OPD H, OPD D, etc.) for sequential reactions (HER, DER, etc.) at electrode/solution interfaces are determined using the phase-shift method and correlation constants, which have been suggested and developed by Chun et al. The basic procedure of the phase-shift method, the Frumkin, Langmuir, and Temkin adsorption isotherms of OPD H and OPD D and related electrode kinetic and thermodynamic parameters, i.e., the fractional surface coverage ($0{\leq}{\theta}{\leq}1$) vs. potential (E) behavior (${\theta}$ vs. E), equilibrium constant (K), interaction parameter (g), standard Gibbs energy (${\Delta}G_{\theta}{^{\circ}}$) of adsorption, and rate (r) of change of ${\Delta}G_{\theta}{^{\circ}}$ with ${\theta}$ ($0{\leq}{\theta}{\leq}1$), at the interfaces are briefly interpreted and summarized. The phase-shift method and correlation constants are useful and effective techniques to determine the Frumkin, Langmuir, and Temkin adsorption isotherms and related electrode kinetic and thermodynamic parameters (${\theta}$ vs. E, K, g, ${\Delta}G_{\theta}{^{\circ}}$, r) at electrode/solution interfaces.

Effect of Ethanol on the Protolytic Properties of the Vitamins B Group

  • Ghasemi, J.;Shiri, F.
    • Journal of the Korean Chemical Society
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    • v.51 no.1
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    • pp.21-30
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    • 2007
  • A multiwavelength spectrophotometric titration method was applied to study protolytic constants of four water-soluble vitamins, folic acid(vitamin B9 or B0), thiamine(vitamin B1), riboflavin(vitamin B2) and pyridoxal (vitamin B6) in binary ethanol-water mixtures at 25oC and an ionic strength of 0.1M NaNO3. The protolytic equilibrium constants, spectral profiles, concentration diagrams and also the number of components has been calculated from the curve fitting of the pH-absorbance data with appropriate mass balance equations by an established factor analysis model. DATAN program was used for determination of acidity constant and SPECFIT program was used for calculation of standard deviations and partial correlation coefficients. A glass electrode calibration procedure based on the four parameter equation pH=α+SpcH+JH+[H+]+ JOH-Kw/[H+] based on the Gran,s plots was used to obtain pH-readings in the concentration scale (pcH). The effect of the solvent on the protolytic constants was discussed.

Characteristics of Chlorinated VOCs Adsorption over Thermally Treated Silica Gel (열처리 실리카겔의 염소계 휘발성 유기화합물 흡착특성 연구)

  • Nam, Kyung Soo;Kwon, Sang Soog;Yoo, Kyung Seun
    • Applied Chemistry for Engineering
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    • v.18 no.3
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    • pp.245-250
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    • 2007
  • Adsorption characteristics of 1,2-dichlorobenzene on the surface of heat treated silica gel were determined by the moment analysis. The heat treatment of the silica gel was performed at temperatures of 150, 500, and $800^{\circ}C$ and pulse-response of 1,2-dichlorobenzene was measured in a gas chromatograph equipped with thermal conductivity detector (TCD) using the packed column. Equilibrium adsorption constants and isosteric heat of adsorption were recorded the highest value at $500^{\circ}C$. This might be due to the increase of interaction between silica surface and 1,2-dichlorobenzene as the decrease of OH concentration and moisture by increase of heating temperature. Axial dispersion coefficient calculated by the moment method was about $0.046{\times}10^{-4}{\sim}1.033{\times}10^{-4}m^2/sec$ and pore diffusivity of heat treated silica gel at $500^{\circ}C$ measured the lowest value. Because heat treating at $800^{\circ}C$ caused the specific surface area to reduce, equilibrium adsorption constants and isosteric heat of adsorption were decreased.

Label-free Detection of the Transcription Initiation Factor Assembly and Specific Inhibition by Aptamers

  • Ren, Shuo;Jiang, Yuanyuan;Yoon, Hye Rim;Hong, Sun Woo;Shin, Donghyuk;Lee, Sangho;Lee, Dong-Ki;Jin, Moonsoo M.;Min, Irene M.;Kim, Soyoun
    • Bulletin of the Korean Chemical Society
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    • v.35 no.5
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    • pp.1279-1284
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    • 2014
  • The binding of TATA-binding protein (TBP) to the TATA-box containing promoter region is aided by many other transcriptional factors including TFIIA and TFIIB. The mechanistic insight into the assembly of RNA polymerase II preinitation complex (PIC) has been gained by either directly altering a function of target protein or perturbing molecular interactions using drugs, RNAi, or aptamers. Aptamers have been found particularly useful for studying a role of a subset of PIC on transcription for their ability to inhibit specific molecular interactions. One major hurdle to the wide use of aptamers as specific inhibitors arises from the difficulty with traditional assays to validate and determine specificity, affinity, and binding epitopes for aptamers against targets. Here, using a technique called the bio-layer interferometry (BLI) designed for a label-free, real-time, and multiplexed detection of molecular interactions, we studied the assembly of a subset of PIC, TBP binding to TATA DNA, and two distinct classes of aptamers against TPB in regard to their ability to inhibit TBP binding to TFIIA or TATA DNA. Using BLI, we measured not only equilibrium binding constants ($K_D$), which were overall in close agreement with those obtained by electrophoretic mobility shift assay, but also kinetic constants of binding ($k_{on}$ and $k_{off}$), differentiating aptamers of comparable KDs by their difference in binding kinetics. The assay developed in this study can readily be adopted for high throughput validation of candidate aptamers for specificity, affinity, and epitopes, providing both equilibrium and kinetic information for aptamer interaction with targets.