• Title/Summary/Keyword: Chain complexes

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DFT Study of Bis(Crown-Ether) Analogue of Troger’s Base Complexed with Bisammonium Ions: Hydrogen Bonds

  • Kim, Kwan-Ho;Choe, Jong-In
    • Bulletin of the Korean Chemical Society
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    • v.27 no.11
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    • pp.1737-1740
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    • 2006
  • The optimized structures and complexation energies of bis(18-crown-6-ether) analogue (2) of Trgers base (1) with a series of primary alkylbisammonium ions have been calculated by DFT B3LYP/6-31G(d,p) method. The calculated complexation efficiency (-142.84 kcal/mol) of 2 for butane-1,4-diylbisammonium guest is better than twice of the value (-61.40 kcal/mol) for butylammonium ion. The multiple hydrogen-bond abilities for the complexes are described as the function of the length of the alkyl substituents of the bisammonium guests with normal-alkyl chain [$-(CH_2)_{n-}$, n = 4-8]. The longer bisammonium guest shows the stronger hydrogen-bonding characterizations (the distance and the quasi-linear angle of the N-H…O) to the host 2 than the shorter bisammonium ions. These calculated results agree with the experimental data of the complexation of 2 with bisammonium salts ([$NH_3(CH_2)_nNH_3$] $Cl_2$).

The Study for the Sequestration of $Ca^{2+}$ by the Micelle Colloid of Nonionic Sunactants (비이온성 계면활성제의 미셀 콜로이드에 의한 $Ca^{2+}$의 은폐에 대한 연구)

  • 권오윤;백우현
    • Journal of Environmental Science International
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    • v.1 no.1
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    • pp.69-76
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    • 1992
  • The effects of $Ca_{2+}$ ion on the formation of micelle colloid of nonionic surfactants, nonylphenol-(ethylene oxide)n [NP-(EO)n: n= 11, 40, 100) were investigated by the iodine solubilization method. The characteristics of spectra depended on the concentration of $Ca_{2+}$ ion and the number of EO unit. Above CMC(critical micelle concentration), the intensity of the CT (charge transfer) band by the addition of $Ca_{2+}$ ion for the NP-(EO)11 and NP-(EO)40 increased and when decreased and for the NP-(EO)In continuously increased. The increase in the intensity of CT band were attributed to the compactness of micelle in the presence of $Ca_{2+}$ ion. These phenomena may be explained by the fact that the linear ethylene oxide (EO) chain, relatively free to assume various configuration in aqueous solution, could form a pseudo-crown ether structures capable of forming complexes with $Ca_{2+}$ ion.

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A Study on Electronic Interaction in Dimetallic Complexes with Conjugated Chain (공액사슬로 연결된 이핵금속착체의 전자적 상호작용에 관한 연구)

  • Chung, Min-Chul;Munetaka Akita
    • Journal of the Korean Institute of Electrical and Electronic Material Engineers
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    • v.17 no.6
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    • pp.652-660
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    • 2004
  • The cis-hex-3-ene-1,5-diynyl-bridged diiron compound 3, [(η$^{5}$ - $C_{5}$ M $e_{5}$ ) Fe(dppe)]$_2$($\mu$-C≡C-CH=CH-C≡C), have been prepared and characterized by cyclic voltammetry(CV), and electronic spectroscopy (UV-VIS and near-IR, NMR). From the results, compound 3 show two well resolved, single-electron, reversible oxidation waves by CV, and comproportionation constant(Kc) calculated from the CV data for compound 3. The Mixed-valence (MV) radical cation 3$^{+}$ show strong absorptions in the near IR, 1586 nm, and this band is more readily assigned as MV $\pi$-$\pi$ band of delocalized complex (Robin-Day Mixed-valence Class III), and the $H_{ab}$ , effective coupling parameter are most consistent with electronic delocalization.

NATURAL FILTRATIONS OF SOME PLETHYSMS

  • Kim, Young-Hie;Ko, Hyoung J.;Lee, Kyung-Ae
    • Bulletin of the Korean Mathematical Society
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    • v.37 no.1
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    • pp.191-207
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    • 2000
  • Let R be a ommutative ring with unity and F a finite free R-module. For a nonnegative integer r, there exists a natural filtration of$S_r(S_2F)$ such that its associated graded module is isomorphic to $\Sigma_{{\lambda}{\epsilon}{\tau}_r}\;L_{\lambda}F$, where ${\Gamma}_{\gamma}$ set of partitions such that $$\mid${\lambda}$\mid$-2r,{{\widetilde}{\lambda}}-{{\widetilde}{\lambda}}_1},...,{{\widetilde}{\lambda}}_k},\;each\;{{\widetilde}{\lambda}}_t}$,is even. We call such filtrations plethysm formulas. We extend the above plethysm formula to the version of chain complexes. By plethysm formula we mean the composition of universally free functors. $Let{\emptyset}:G->F$ be a morphism of finite free R-modules. We construct the natural decomposition of $S_{r}(S_2{\emptyset})$,up to filtrations, whose associated graded complex is isomorphic to ${\Sigma}_{{\lambda}{\varepsilon}{\tau}}_r}\;L_{\lambda}{\emptyset}$.

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Synthesis, Crystal Structure and Spectroscopic Characterization of a Copper(II) Complex Coordinated by 2,2'-Dipyridylstearylamine

  • O, Yeong Hui;Kim, Ji Yeong;Park, Yeong Ja
    • Bulletin of the Korean Chemical Society
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    • v.22 no.4
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    • pp.379-382
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    • 2001
  • A new ligand containing the long aliphatic hydrocarbon chain, dipyridylstearylamine (dps) and its copper(Ⅱ) complex, Cu(dps)(NO3)2 have been prepared. The copper complex was characterized structurally and spectroscopically. The XRD crystal structure of the copper complex reveals that copper is octahedrally coordinated by dps and two nitrato ligands. The nitrato groups ligate asymmetrically to the copper. Crystal data are P1bar, a=8.249(2), b=10.416(3), $c=20.915(4)\AA$, $\alpha=86.54(2)$, $\beta=84.026(2)$, $\gamma=72.32(2)^{\circ}$, V=1702.7(7) $\AA3$ , Z=2, ${\lambda}$(Mo $K\alpha)=0.71073\AA$, $\mu=0.689$ mm-1 , T=293(2) K, R=0.0560 for 3529 reflections. The dps and the copper complex are stable in the air and the copper complex exhibits features of typical of other copper(Ⅱ) complexes containing dipyridylamine-based ligand.

Luminescence Quenching of Tris(2,2'-bipyridine) Ruthenium(II) Complex by Viologens in Anionic Micellar and Polyelectrolyte Solutions: Variation with Alkyl Chain of Viologens

  • Park, Joon-Woo;Suk, Mi-Yeon;Ahn, Byung-Tae
    • Bulletin of the Korean Chemical Society
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    • v.11 no.6
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    • pp.552-557
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    • 1990
  • Luminescence quenching reactions of photoexcited tris(2,2'-bipyridine)ruthenium (Ⅱ) complex cation, $Ru(bpy)_3\;^{2+}$, by dialkylviologens (dimethyl, dioctyl, dibenzyl, methyloctyl, methyldodecyl, and methylbenzyl) were studied in sodium dodecylsulfate (SDS), poly(styrenesulfonate) (PSS), and poly(vinylsulfonate) (PVS) solutions. The relative quenching rate varies widely with the microheterogeneous media employed: the highest quenching rate is observed for methyldodecylviologen in homogeneous aqueous medium, dibenzylviologen in SDS and PVS solutions, and dimethylviologen in PSS solution; the lowest rate is found for dimethylviologen in homogeneous medium and SDS solution, methyldodecylviologen in PSS and PVS solutions. These results were interpreted in terms of reduction potential of viologens, affinity of $Ru(bpy)_3\;^{2+}$ and viologens to the microparticles, and the structures of the viologen-colloid complexes.

Template Synthesis and Characterization of Copper(Ⅱ) Complexes of a Polyaza Non-Macrocyclic or a Bis(macrocyclic) Ligand

  • 강신걸;유기석;정수경;김창수
    • Bulletin of the Korean Chemical Society
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    • v.17 no.4
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    • pp.331-334
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    • 1996
  • New copper(Ⅱ) complex of the pentaaza non-macrocyclic ligand 1-(2-aminoethyl)-3-(N-{2-aminoethyl}aminomethyl)-1,3-diazacyclohexane (2) and a dinuclear copper(Ⅱ) compex of the bis(macrocyclic) ligand 3, in which two 1,5,8,10,12,15-hexaazabicyclo[11.3.11.5]heptadecane subunits are linked together by an ethylene chain through the uncoordinated nitrogen (N10) atoms, have been prepared selectively by the reaction of the metal ion, 1,4,8-triazaoctane, ethylenediamine, and formaldehyde. The dinuclear complex [Cu2(3)]4+ has been also prepared by the reaction of [Cu(2)]2+ with ethylenediamine and formaldehyde. The reaction products largely depend on the molar ratio of the reactants employed. The mononuclear complex or each macrocyclic subunit of the dinuclear complex contains one 1,3-diazacyclohexane ring and has a square-planar geometry with a 5-6-5 or 5-6-5-6 chelate ring sequence. In acidic solution, the copper(Ⅱ) complex of 2 dissociates more slowly than those of other related non-cyclic polyamines.

Optimal filter materials for protist quantification via droplet digital PCR

  • Juhee Min;Kwang Young Kim
    • ALGAE
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    • v.39 no.1
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    • pp.51-56
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    • 2024
  • The use of droplet digital polymerase chain reaction (ddPCR) has greatly improved the quantification of harmful protists, outperforming traditional methods like quantitative PCR. Notably, ddPCR provides enhanced consistency and reproducibility at it resists PCR inhibitors commonly found in environmental DNA samples. This study aimed to determine the most effective filter material for ddPCR protocols by assessing the reproducibility of species-specific gene copy numbers and filtration time across six filter types: cellulose acetate (CA), mixed cellulose ester (MCE), nylon (NY), polycarbonate (PC), polyethersulfone (PES), and polyvinylidene fluoride (PVDF). The study used two species of Chattonella marina complexes as a case study. Filtration rates were slower for NY, PC, and PVDF filters. Moreover, MCE, NY, PES, and PVDF yielded lower DNA amounts than other filters. Importantly, the CA filter exhibited the lowest variance (38-39%) and the highest determination coefficients (R2 = 0.92-0.96), indicating superior performance. These findings suggest that the CA filter is the most suitable for ddPCR quantification of marine protists, offering quick filtration and reliable reproducibility.

Potentiometric Study of Transition Metal Ions Complexes of Hexadentate($N_4$, $O_2$) Ligands (질소-산소계 여섯 자리 리간드들의 전이금속이온 착물에 대한 전위차법 연구)

  • Kim, Sun-Deuk;Kim, Jun-Kwang;Lee, Woo-Sik
    • Journal of the Korean Chemical Society
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    • v.44 no.6
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    • pp.518-525
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    • 2000
  • The open-chain hexadentate N$_4$, O$_2$ ligands 1,13-bis(2-hydroxybenzyl)-2,5,9,12-tetraazatridecane-tetrahydrochloride (BSATD${\cdot}$4HCl) and 1,14-bis (2-hydroxybenzyl)-2,6,9,12-tetraazatetradecane-tetrahydrochloride (BSATED${\cdot}$ 4HCl) have been synthesized as their tetrahydrochloride salt and characterized by EA, IR, NMR and Mass. Their proton dissociation constants(log$K^{n}_{H}$) and stability constants(log$K_{ML}$) for Cu(II), Ni(II), Co(II), and Zn(II) ions were determined in aqueous solution by potentiometry and compared with those of analogous N$_4$, O$_2$ ligands contain ethylenic spacers or propylenic spacers, which make six-membered chelate rings between the aliphatic nitrogen atoms. Synthesis and characterization of [Cu(BSATD)]ClO$_4$ and [Cu(BSATED)](ClO$_4$)$_2$ complexes are described.

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Host-Guest Interactions of Cyclic and Acyclic Polyethers with Alkylammonium Ions (고리 및 비고리 폴리에테르와 알킬암모늄 이온과의 호스트-게스트 상호작용)

  • Jeong, Jong Hwa;Kim, Dae Yeon;Lee, Sim Seong
    • Journal of the Korean Chemical Society
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    • v.38 no.7
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    • pp.509-515
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    • 1994
  • The interactions of 11 kinds of primary and secondary alkylammonium ions with cyclic (12C4, 15C5, 18C6, DT18C6 and DA18C6) and acyclic$(Q_2O_5)$ polyethers were investigated by NMR titration and conductometry. All of the alkylammonium ions under investigation form the relatively stable 1 : 1 complexes with crown ethers and acyclic polyether by H-bond. The interactions of alkylammonium ions with analogeous hosts having different size were in the order of 18C6 > 15C5 > 12C4, and the strengthes of donor atoms toward the alkylammonium ions were in the order of N > O > S. 18C6 forms more favorable interactions with primary alkylammonium ions than secondary alkylammonium ions, otherwise DA18C6 shows the opposite behaviors. The stability constants for complexations of 18C6 with the alkylammonium ions were determined conductometrically in methanol at 25$^{\circ}C$. The major factors affecting the stability of complexes were the type of alkylammonium ions, the length of alkyl-chain and the steric hindrance due to the structure of alkyl groups on complexation.

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