• 제목/요약/키워드: Chemical coupling

검색결과 744건 처리시간 0.053초

Spin Exchange Coupling in Dimethoxo-Bridged Dichromium(III) Complexes: A Density Functional Theory Study

  • Kang, Dae-Bok
    • Bulletin of the Korean Chemical Society
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    • 제29권5호
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    • pp.963-968
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    • 2008
  • For the [$Cr_2(H_2tmp)_2Cl_4$] compound, simplified models with two bridging methoxo ligands have been studied. The influence of the bridging Cr-O-Cr bond angles on the exchange coupling between metal atoms in the model compound has been analyzed by means of density functional calculations with the broken-symmetry approach. Coupling constant calculated for the full structure is in good agreement with the experimentally reported value, confirming the validity of the computational strategy used in this work to predict the exchange coupling in a family of related dinuclear Cr(III) compounds. The calculations indicate a good correlation between the calculated coupling constant and the sum of the squared energy gap of three pairs of metal $t_{2g}$ OMSOs with a limited variation of the Cr-O-Cr angle. The spin density distribution and the mechanism of magnetic coupling interactions are discussed.

PVC-Ni 복합재의 전기적 ${\cdot}$ 기계적 성질에 미치는 Titanate Coupling Agent 의 영향 (The Effect of Titanate Coupling Agents on the Electrical and Mechanical Properties of PVC-Ni Composite Systems)

  • 문탁진;이미경;김선호
    • 대한화학회지
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    • 제29권3호
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    • pp.319-327
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    • 1985
  • 충진제의 함량, titanate계 coupling agent의 종류, 처리량에 따른 PVC-Ni 복합재의 전기적.기계적 성질을 연구하였다. coupling agents처리에 의해 충진제의 분산상태가 양호해지고, 충진제 표면의 불순물이 대체되어 복합재의 전기저항은 감소되며 기계적 성질을 연구하였다. coupling agent처리에 의해 충진제의 분산상태가 양호해지고, 충진제 표면의 불순물이 대체되어 복합재의 전기저항은 감소되며 기계적 성질들은 향상되나 과량의 coupling agent의 처리는 이들 효과를 상쇄함을 보였다.

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Synthesis of Terphenyls and Quaterphenyls via the Nickel N-Heterocyclic Carbene-Catalyzed Cross-Coupling of Neopentyl Arenesulfonates with Aryl Grignard Reagents

  • Jo, Hyun-Jong;Kim, Chul-Bae;Ryoo, Tae-Yong;Ahn, Bo-Kyoung;Park, Kwang-Yong
    • Bulletin of the Korean Chemical Society
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    • 제31권12호
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    • pp.3749-3754
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    • 2010
  • Various terphenyl and quaterphenyl derivatives were prepared by the Ni-NHC catalyzed cross coupling of the corresponding biphenyl- and terphenyl-sulfonates with arylmagnesium bromides. The reactions proceeded rapidly via a nucleophilic aromatic substitution of the alkoxysulfonyl moieties by the aryl nucleophiles to afford high yields within just 1.5 h at room temperature in spite of the low reactivity of the sulfur electrophiles.