• Title/Summary/Keyword: Hydrogen Bond

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The Substrate Specificity of Pyranose Oxidase: the Activity of L-Gulono-1 4-lactone Oxidase

  • Kwon, Jae-youl;Kang, Sa-Ouk
    • Proceedings of the Korean Biophysical Society Conference
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    • 1997.07a
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    • pp.37-37
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    • 1997
  • The catalytic efficiency of pyranose oxidase (EC 1.1.3.10.) determined for various sugars showed that D-glucose is the preferred substrate and the enzyme oxidized the various aldonolactones. The specificity constants of pyranose oxidase determined for deoxy- and deoxyfluoro-D-glucoses showed that a hydroxy group at C-4 of D-glucose acts as a hydrogen-bone acceptor, at C-6 as a hydrogen-bond donor, and at C-1 as a hydrogen-bond donor.(omitted)

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Solvatochromic Effects and Hydrogen Bonding Interactions of 4-(4-Nitrophenylazo)-1-naphthol Derivatives

  • 신동명;권오악
    • Bulletin of the Korean Chemical Society
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    • v.16 no.7
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    • pp.574-577
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    • 1995
  • Solvatochromic effect and hydrogen bonding interaction of NPNOH, NPNO- and NPNOR were investigated. Electronic transition energies of the dyes were plotted against empirical solvent polarity parameters, Taft's π* and Reichardt's ET(30). Good correlations were observed when the excitation energies were plotted against the energy calculated by multiple linear regression method which was developed by Taft. There is an intrinsic difference between betaine for ET(30) polarity scale and the azoderivative, which is derived from the specific hydrogen bond incurred with probe molecules and solvents. The hydrogen bonding plays a very important role for stabilization of an excited state molecule by solvents especially when a solute possesses a negative charge as with NPNO-.

The 3-[3α(2α-Hydroxy)pinane]-4,5-(pinan)-1,3-oxazolidine Synthesis, Structure and Properties

  • Bialek, Magdalena;Trzesowska, Agata;Kruszynski, Rafal
    • Bulletin of the Korean Chemical Society
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    • v.28 no.1
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    • pp.89-94
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    • 2007
  • The new pinane derivative containing unique multifused ring system was synthesized. The crystal, molecular and electronic structure of the title compound has been determined. Both pinane ring systems have the same conformation. The five-membered oxazolidine ring exists in twisted chair conformation. The structure is expanded through O-H…O hydrogen bond to semiinfinite hydrogen-bonded chain. The bond lengths and angles in the optimised structure are similar to the experimental ones. The CH3 and CH2 groups (except this of oxazolidine ring) are negatively charged whereas the CH groups are positively charged. The largest negative potential is on the oxygen atoms. The C-N natural bond orbitals are polarised towards the nitrogen atom (ca. 61% at N) whereas the C-O bond orbitals are polarised towards the oxygen atom (ca. 67% at O). It is consistent with the charges on the nitrogen and oxygen atom of oxazolidine ring and the direction of the dipole moment vector (3.08 Debye).

Substituent Effect in Photochemistry of ${\beta}-Ethoxy-{\alpha}-halopropiophenones$

  • Cho, Sung-Su;Park, Bong-Ser
    • Journal of Photoscience
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    • v.12 no.2
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    • pp.83-85
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    • 2005
  • Photochemical reactivities of ${\beta}-ethoxypropiophenones$ are changed dramatically by putting a halogen at a position to the carbonyl functionality. ${\alpha}-Bromo-{\beta}-ethoxypropiophenone$ gives C-Br bond cleavage products solely, but ${\alpha}-chloro-{\beta}-ethoxypropiophenone$ forms mainly the Yang photocyclization products upon irradiation. The different reactivities of two compounds can be explained by relative rates of C-X bond cleavage and a-hydrogen abstraction.

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The Hydrogen Binding Property Study by Density Functional Theory for Zr, V, Fe and Al (밀도 함수를 이용한 지르코니움, 바나듐, 철과 수소와의 반응성 연구)

  • Park, Taesung;Lee, Taeckhong
    • Journal of Hydrogen and New Energy
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    • v.25 no.6
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    • pp.602-608
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    • 2014
  • The sequence of bond overlap population of metal hydrogen binding is in Al-H > Fe-H > Zr-H > V-H. This results shows the binding energy of Al-H is the biggest in this metals (Al, Fe, Zr, and V) and hydrogen interaction. The Vanadium-hydrogen binding shows the weakest binding energy compared to other metals and it causes easy hydrogen desorption from the corresponding metals. The net charge of Al-H show the biggest value of 0.2248 and the severe localizations of electrons around aluminum and imply strongest covalent binding nature in these metals. This study is applicable to the purification of hydrogen in other bulk gas.

Mo-Mn Metallizing on Sintered Alumina and It합s Bond Strength (소결 알루미나의 금속접합 및 접합강도에 관한 연구)

  • Lee, Joon;Kim, Young-Tai;Jang, Sung-Do;Son, Yong-Bae
    • Journal of the Korean Ceramic Society
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    • v.22 no.6
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    • pp.58-70
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    • 1985
  • The bond strength of metal to ceramic sealing in Mo-Mn metallizing was investigated by examining the effects of flux composition in alumina ceramics particle size of molybdenum metal powder wet hydrogen atmosphere and temperature in metallizing. The maximum bond strength was obtained when the glass phase filled almost all the microstructural cavities around the interfacial area with few micropores. Such a favorable microstrcutre waas formed and maximum bond strength was observed between 130$0^{\circ}C$. Also the metal to ceramic bond strength was increased using finer molybdenum metal powder than coarse powder. When content of $SiO_2$ in the flux of alumina ceramics was constant metal to ceramic bond strength was improved with increasing the ratio of CaO to MgO in the flux.

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Molecular Dynamics Investigation of the Effects of Concentration on Hydrogen Bonding in Aqueous Solutions of Methanol, Ethylene Glycol and Glycerol

  • Zhang, Ning;Li, Weizhong;Chen, Cong;Zuo, Jianguo;Weng, Lindong
    • Bulletin of the Korean Chemical Society
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    • v.34 no.9
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    • pp.2711-2719
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    • 2013
  • Hydrogen bonding interaction between alcohols and water molecules is an important characteristic in the aqueous solutions of alcohols. In this paper, a series of molecular dynamics simulations have been performed to investigate the aqueous solutions of low molecular weight alcohols (methanol, ethylene glycol and glycerol) at the concentrations covering a broad range from 1 to 90 mol %. The work focuses on studying the effect of the alcohols molecules on the hydrogen bonding of water molecules in binary mixtures. By analyzing the hydrogen bonding ability of the hydroxyl (-OH) groups for the three alcohols, it is found that the hydroxyl group of methanol prefers to form more hydrogen bonds than that of ethylene glycol and glycerol due to the intra-and intermolecular effects. It is also shown that concentration has significant effect on the ability of alcohol molecule to hydrogen bond water molecules. Understanding the hydrogen bonding characteristics of the aqueous solutions is helpful to reveal the cryoprotective mechanisms of methanol, ethylene glycol and glycerol in aqueous solutions.

Characterization of pH Dependent Properties of mCherry Mutant, I202T (형광 단백질 mCherry-I202T의 pH 감응성 분석)

  • Lee, Sangmin;Chung, Minsub
    • Applied Chemistry for Engineering
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    • v.32 no.1
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    • pp.10-14
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    • 2021
  • mCherry is one of the well-understood red fluorescent proteins which has a similar tertiary structure as GFPs, but pH resistant due to the lack of hydrogen bond network. Whereas mCherry-I202T showed far-red fluorescence and also pH sensitive property because of the additional hydrogen bond formed by substituting Ile of 202 amino acid sequence on mCherry with Thr. In order to verify the pH sensitive characteristic of mCherry-I202T owing to the extension of hydrogen bond, UV-vis spectrum was measured over the range of acidic to basic pH. We also demonstrate further possibilities of applying mCherry-I202T as a pH sensor.

Degradation of Membrane for PEM Fuel Cell with Hydrogen Peroxide (과산화수소에 의한 고분자전해질 연료전지 막의 열화)

  • Kim, Tae-Hee;Lee, Jung-Hun;Park, Kwon-Pil
    • 한국신재생에너지학회:학술대회논문집
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    • 2006.11a
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    • pp.438-442
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    • 2006
  • The degradation of Nafion membrane by hydrogen peroxide was investigated in polymer electrolyte membrane fuel cell (PEMFC). Degradation tests were carried out in a solution of $10{\sim}30%$ hydrogen peroxide containing 4ppm $Fe^{2+}$ ion which is well known as Fenton's reagent at $80^{\circ}C$ for 48hr. Characterization of degraded membranes were examined through the IR, Water-uptake, Ion exchange capacity, mechanical strength and $H_2$ permeability. After degradation, C-F, S-O and C-O chemical bonds of membrane were broken by radical formed by $H_2O_2$ decomposition. Breaking of C-F bond which is the membrane backbone reduced the mechanical strength of Nafion membrane and hence induced pinholes, resulting in increase of $H_2$ crossover through the membrane. Also the decomposition of C-O and S-O, side chain and terminal bond of membrane, decreased the ion exchange capacity of the membrane.

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Influence of Solvents on Rates of Reactions of 2,4-Dinitro Substituted Halobenzenes with Substituted Anilines (III) (2,4-이니트로할로벤젠과 치환된 아닐린의 반응속도에 대한 용매효과 (제3보))

  • Hai Whang Lee;Ikchoon Lee
    • Journal of the Korean Chemical Society
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    • v.22 no.4
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    • pp.221-228
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    • 1978
  • Rates of reactions of 2,4-dinitrofluorobenzene and 2,4-dinitrobromobenzene with para substituted anilines in acetonitrile-methanol binary mixtures have been measured. It has been shown that methanol acts as nucleophilic catalyst upon reaction of 2,4-dinitrobromobenzene with anilines and as bifunctional catalyst upon reaction of 2,4-dinitrofluorobenzene with anilines. The electrophilic catalysis by methanol probably consists of formation of hydrogen bond in the transition state between alcoholic hydrogen and leaving group, fluorine. Nucleophilic catalysis by methanol may be ascribed to formation of hydrogen bond between alcoholic oxygen and amine hydrogen in the transition state.

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