• Title/Summary/Keyword: Ionic bond

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Structure and Electrical Properties of Li2O-TiO2-P2O5/ Glasses (Li2O-TiO2-P2O5계 유리의 구조와 전기적 성질)

  • 윤기현;곽만석;이용근
    • Journal of the Korean Ceramic Society
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    • v.40 no.2
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    • pp.178-183
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    • 2003
  • Electrical conductivity of$50Li_2O-xTiO_2-(50-x)P_2O_5$ glasses has been studied with an increase of the intermediate$TiO_2$content. Thermal properties were observed from TG-DTA measurement and the variation of glass structure was investigated by FT-IR. The density and glass transition temperature increased with an increase of the $TiO_2$ content. These results were attributed to the fact that bond strengthening was occurred because of the formation of P-O-Ti cross linkages in the glass. The ionic conductivity increased with $TiO_2$ content and a maximum value, $1.2{imes}10^{-6}$S/cm showed at x=20. The ionic conductivity showed a large increasement as a result that the pyrophosphate group become the predominant structural unit. This result can explain that Li ions mobility increased as a number of non-bridging oxygen on phosphate units increased.

Effect of Bond Valence on Microwave Dielectric Properties of (${Pb_{1-x}}{Ca_x}$)(${Ca_{1/3}}{Nb_{2/3}}$)$O_3$Ceramics ((${Pb_{1-x}}{Ca_x}$)(${Ca_{1/3}}{Nb_{2/3}}$)$O_3$세라믹스의 마이크로파 유전특성에 미치는 결합원자가의 영향)

  • 김응수;이형규
    • Journal of the Korean Ceramic Society
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    • v.38 no.7
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    • pp.678-682
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    • 2001
  • 복합 페롭스카이트(P $b_{1-x}$C $a_{x}$)(C $a_{1}$3/N $b_{2}$3/) $O_3$(0.6$\leq$x$\leq$0.8) 세라믹스의 마이크로파 유전특성과 결합원자가사이의 관계에 대하여 고찰하였다. 유전상수(K)는 Ca 치환량이 증가함에 따라 A-자리의 이온반경 세제곱에 비례하여 감소하며, Qf 값은 증가하였다. Ca 치환량이 증가함에 따라 관찰된 이온분극률($\alpha$$_{obs}$)과 이론적인 이온분극률($\alpha$$_{theo}$) 사이의 편차는 3.47%에서 6.37%로 증가하였다. 이는 A-자리 결합원자가의 감소에 따른 결합강도의 감소로 해석하였다. 소결시편의 공진주파수의 온도계수(TCF)는 AB $O_3$페롭스카이트 화합물의 A-자리 결합원자가에 의존하였다.

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Equilibrium Geometries of the Neutral and Ionic Clusters of $Ag_7$, $Ag_8$, and $Ag_9$ Studied by Intermediate Neglect of Differential Overlap Method

  • Yu, Chang Hyeon;Seon, Ho Seong
    • Bulletin of the Korean Chemical Society
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    • v.21 no.10
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    • pp.953-954
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    • 2000
  • The equilibrium geometrical structures of silver atom clusters at their electronic ground states have been theo-retically determined by using the nonrelativistic semiempirical INDO/1 method. The clusters investigated are Agn, Agn+, and Agn- (n = 7 , 8, 9). In order to find the most stable structure, i.e., the global minimum in energy hypersurface, geometry optimization and energy calculation processes have been repeatedly performed for all the possible graphical models by changing the bond parameters (resonance integral values). The heptamers are pentagonal bipyramidal-Ag7(D5h), Ag7+ (D5h), Ag7- (D5h); the octamers are pentagonal bipyramidal with one atom capped-Ag8(D2d), Ag8+ (Cs), Ag8- (D2d); the nonamers are pentagonal bipyramidal with two atoms capped -Ag9(C2v), Ag9+ (C2v), Ag9- (C2v). Our structures are in good agreement with those by ab initio calculations ex-cept for the anionic Ag9- cluster. And it is noted that the INDO/1 method can accurately predict the Ag cluster geometries when a proper set of bond parameters is used.

Synthesis and structure analysis of the bis(dicyclohexylammonium) chromate dihydrate complex, [(C6H11)2NH2]2[CrO4]·2H2O

  • Kim, Chong-Hyeak;Moon, Hyoung-Sil;Lee, Sueg-Geun
    • Analytical Science and Technology
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    • v.20 no.5
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    • pp.448-451
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    • 2007
  • A new bis(dicyclohexylammonium) chromate dihydrate complex, $[(C_6H_{11})_2NH_2]_2[CrO_4]{\cdot}2H_2O$, (I), has been synthesized and its structure analyzed by FT-IR, EDS, elemental analysis, ICP-AES, and single crystal X-ray diffraction methods. The Cr(VI) complex (I) is tetragonal system, I${\bar{4}}$2d space group with a = 12.5196(1), b = 12.5196(1), c = $17.3796(3){\AA}$, a = ${\beta}$ = ${\gamma}$ = $90^{\circ}$, V = $2724.09(6){\AA}^3$, Z = 4. The crystal structure of complex (I) consists of tetrahedral chromate $[CrO_4]^{2-}$ anion, two organic dicyclohexylammonium $[(C_6H_{11})_2NH_2]^+$ cations and two lattice water molecules. The chromate anion and protonated dicyclohexylammonium cation is mainly constructed through the ionic bond. The cyclohexylammonium rings of the dicyclohexylammonium cation take the chair form and vertical configuration with each other. The N-H${\cdot}$O and O-H${\cdot}$O hydrogen bond networks between the $N_{dicyclohexylammonium}$, $O_{water}$ and $O_{chromate}$ atom lead to self-assembled molecular conformation and stabilize the crystal structure.

MO Interpretation for Anticancer Activity of Pt-complexes (백금착물 (II) 의 항암성에 관한 분자궤도론적 해석 (제1보))

  • Byung-Kak Park;Yeo Hwhan-Jin
    • Journal of the Korean Chemical Society
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    • v.29 no.4
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    • pp.348-355
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    • 1985
  • Extended Huckel Calculation of cis-and trans-dichloro diammine platinum(II), dichloroethylene diamine platinum(II) and their N-mono, di, tri and tetra-methylated or ethylated ones were carried out to investigate their anticancer activity. It was found that the net charge of two chlorine atoms in cis-isomers are greater than those in trans-ones and Pt-Cl bond energies of the former are less than that of the latter, indicating that Pt-Cl bond in cis-isomers has greater ionic character than that in trans-ones and Cl atoms in the former are easier to dissociated as Cl- than those in the latter. Also, the values of $b_{2g}-b_{1g}$ energy difference, ${\Delta}_1$ were found to be greater in cis-isomers than in trans-one without exceptions. For the substitution of methyl for H atom in ammine and ethylenediamine Pt-Cl bond strength shows the tendency to increase with increasing in number of methyl group. Accordingly, We believe that two Cl atoms in $PtLCl_2$-complexes (L: NH$_3$, en) are dissociated in the first step of the action of anticancer.

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Purification and Immobilization of Cyclodextrin glucanotransferase from recombinant Bacillus subtilis

  • Seo, Hyo-Jin;Kim, Yeong-Hwa;Kim, Seong-Gu
    • 한국생물공학회:학술대회논문집
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    • 2001.11a
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    • pp.671-674
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    • 2001
  • Cyclodextrin glucanotransferase(CGTase) derived from recombinant Bacillus subtilis was partial purified and concentrated by ultrafiltration. The prepared CGTase were immobilized on various matrices by ionic interaction or covalent bond. CGTase covalently bound on CNBr-activated sepharose 4B were identified to be the highest immobilization activity among various immobilization methods. The optimum conditions for CGTase immobilization were determined; $30^{\circ}C$, 6Orpm, using O.2g CNBr-activated sepharose 4B in pH 6.0 phosphate buffer and 9hr immobilization.

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Properties of Deep Eutectic Solvents (DESs) and Their Applications (깊은 공융 용매 (DESs) 물성과 응용)

  • Seo, Ho Seong;Park, Byung Heung
    • Journal of Institute of Convergence Technology
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    • v.5 no.2
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    • pp.43-48
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    • 2015
  • Deep eutectic solvents (DESs) are now broadly understood as a new kind of ionic liquid (IL) because they exhibit many characteristics and properties similar with ILs. The DESs made of quaternary ammonium salt blended with one of hydrogen bonding donor (HBD) compounds behave as ILs even at very low temperature. In this study, properties such as density, viscosity, surface tension, conductivity, and electrochemical behavior of DESs were reported and their applications were reviewed. Study on DESs has been drawn attention on application in metal finishing, but these solvents can be used in a variety of synthesis, and their potentials have been demonstrated in various areas. DESs are expected to offer applicability by extending the types of salts and hydrogen bond donor mixtures.

Dyeing properties of silk fabric with pomegranate colorant (석류색소에 대한 견섬유의 염색성)

  • 신윤숙;조은경
    • Journal of the Korean Society of Clothing and Textiles
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    • v.25 no.2
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    • pp.268-274
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    • 2001
  • Dyeing properties of the colorants extracted from pomegranate hull on silk fabric were investigated. Pomegranate colorants were characterized by FT-IR analysis. Effects of dyeing condition and mordanting on dye uptake, color change and colorfastness were explored. Pomegranate colorants showed high affinity to silk fiber and its isotherm adsorption curve was Langmuir type. Therefore, ionic bond was involved in the adsorption of pomegranate colorants on to silk fiber. Mordants except Fe did not significantly increase dye adsorption. Pomegranate colorants produced mainly yellow color on silk fabric, but the silk mordanted with Fe showed yellow red color. Fastness to washing, perspiration, and rubbing was not improved by mordanting treatment, but light colorfastness was increased by Fe mordant.

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REACTIONS OF POLYACRYLIC ACID WITH HYDROXYAPATITE, ENAMEL AND DENTIN (Hydroxyapatite, 법랑질 및 상아질과 Polyacrylic acid와의 반응에 관한 연구)

  • Kim, Jung-Tae
    • Restorative Dentistry and Endodontics
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    • v.15 no.1
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    • pp.33-43
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    • 1990
  • Reactions of polyacrylic acid with hydroxyapatite, enamel and dentin were examined using infrared spectroscopy for the detection of $COO^-$ ions bonded to substrates. And also atomic aboscorption spectrophotometry and visible spectrophotometry were used to analyze the concentrations of calcium and phosphorus in the filtered solutions. The results were as follows. 1. Chemical adhesion of poly acrylic acid to hydroxyapatite, enamel and dentin was observed by infrared spectroscopy. 2. More calcium and phosphorus were detected in the filtered solutions of sodium polyacrylate-reacted specimens than in the filtered solutions of deionized Water-reacted specimens. 3. Mechanism of adhesion of polyacrylate to substrates is postulated that the bond is ionic in nature by displacement of $Ca^{2-}$ and ${PO_4}^3$ ions from the surface of substrates.

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Near IR Spectroscopic Studies on the Interaction between Acetamide and Lu$(dpm)_3$ in Carbon Tetrachloride

  • 최영상;김홍순;유정아;이상원;박정희;윤창주
    • Bulletin of the Korean Chemical Society
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    • v.17 no.6
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    • pp.511-514
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    • 1996
  • The interactions between Ln(dpm)3 [Ln3+=Eu3+, Yb3+, Pr3+, Sm3+, Tb3+and Ho3+; dpm=tris 2,2,6,6-tetramethylheptane-3,5-dionate] and acetamide in CCl4 solution were investigated using near IR absorption spectroscopy. From the measured 2 νC=O+ amide Ⅲ combination band of acetamide in the region of 2130-2180 nm(4695-4587 cm-1), it was found that acetamide is coordinating through its carbonyl oxygen atom to Ln(dpm)3[C=O…Ln(dpm)3)] and forms only 1 : 1 stoichiometric Ln(dpm)3- acetamide complex. The ΔHo values for the formation of Ln(dpm)3-acetamide obtained from the temperature studies are -39.1, -28.4, -25.5, -24.7, -21.1 and -17.7 kJ mol-1 for Eu(dpm)3, Yb(dpm)3, Pr(dpm)3, Sm(dpm)3, Tb(dpm)3 and Ho(dpm)3, respectively, which are larger than those of the hydrogen bond between amide and various hydrogen acceptors. Except Eu(dpm)3 and Yb(dpm)3, -ΔHovalue increases as the ionic size increases.