• 제목/요약/키워드: Organic molecular structures

검색결과 130건 처리시간 0.027초

Insertion of Alkali Metals into Open Framework, TaPS6 by Using Alkali Metal Halide Fluxes: Single Crystal Structures of K0.18TaPS6, K0.28TaPS6, and Rb0.09TaPS6

  • Do, Jung-Hwan;Dong, Yong-Kwan;Kim, Jung-Wook;Hahn, Song-I;Yun, Ho-Seop
    • Bulletin of the Korean Chemical Society
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    • 제26권8호
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    • pp.1260-1264
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    • 2005
  • Three new quaternary tantalum thiophosphates, $K_{0.18}TaPS_6,\;K_{0.28}TaPS_6,\;and\;Rb_{0.09}TaPS_6$ have been synthesized by using reactive alkali metal halide fluxes and structurally characterized by single crystal X-ray diffraction techniques. The crystal structures of $K_{0.18}TaPS_6,\;K_{0.28}TaPS_6,\;and\;Rb_{0.09}TaPS_6$ contain 3-dimensional open framework anions, $[TaPS_6]^{x-}$(x = 0.09, 0.18, 0.28) with the empty channel which disordered alkali metal cations, $K^+\;and\;Rb^+$ are located in. Crystal data: $K_{0.18}TaPS_6$, tetragonal, space group$I4_1$/acd (no. 142), a=15.874(3) $\AA$, c=13.146(4) $\AA$, V=3312.7(12) ${\AA}^3$, K, Z=16, R1=0.0545. Crystal data: $K_{0.28}TaPS_6$, tetragonal, space group $I4_1$/acd (no. 142), a=15.880(2) $\AA$, c=13.134(3) $\AA$, V=3312.1(10) ${\AA}^3$, Z=16, R1=0.0562. Crystal data: $Rb_{0.09}TaPS_6$, tetragonal, space group I41/acd (no. 142), a=15.893(3) $\AA$, c=13.163(4) $\AA$, V=3324.7(15) ${\AA}^3$, Z=16, R1=0.0432.

양수성 물질에 의한 유기오염물질의 수중 용해도 증가에 분자구조가 미치는 영향 (Effect of Molecular Structures on the Solubility Enhancement of Organic Contaminants by Amphiphiles)

  • 조현희;박재우
    • 대한환경공학회지
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    • 제22권4호
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    • pp.755-764
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    • 2000
  • 토양이나 지하환경에서 소수성 유기오염물질은 자연적으로 존재하는 휴믹물질과 오염된 토양을 세척하는데 사용되는 계면활성제에 의해 거동이 결정되어진다. 거대분자인 휴믹물질은 pseudomicelle을 형성하여 소수성 유기오염물질의 용해도를 증가시키고, 계면활성제 역시 CMC 이상의 농도에서 마이셀을 이루어 오염물질을 흡수하게 된다. 이 논문의 연구 목적은 소수성 유기오염물질로서 네 가지 PAHs와 p,p'-DDT를 사용하여 휴믹산과 세 가지 음이온성 계면활성제에 의한 용해도 증가를 비교해보고, 나아가서는 오염물질의 종류에 따라 어떠한 양상을 보이는지를 알아보는 것이다. 휴믹산에 의한 용해도 증가는 PAHs의 경우에서는 나프탈렌에서 퍼릴렌으로 갈수록 증가하지만 p,p'-DDT는 소수성이 가장 큼에도 불구하고 파이렌보다도 용해도 증가 정도가 낮았다. 음이온성 계면활성제의 경우, SDS 와 SDDBS에 의한 다섯 가지 소수성 유기오염물질의 용해도가 선형적으로 증가한 반면, 쌍둥이 머리(twin-head)를 가진 MADS-12에 의한 용해도 증가는 나프탈렌에서 퍼릴렌으로 갈수록 증가하였지만, p,p'-DDT의 용해도 증가 정도는 퍼릴렌 보다 약간 감소하였다.

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Precise Synthesis of Dendron-Like Hyperbranched Polymers and Block Copolymers by an Iterative Approach Involving Living Anionic Polymerization, Coupling Reaction, and Transformation Reaction

  • Hirao Akira;Tsunoda Yuji;Matsuo Akira;Sugiyama Kenji;Watanabe Takumi
    • Macromolecular Research
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    • 제14권3호
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    • pp.272-286
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    • 2006
  • Dendritic hyperbranched poly(methyl methacrylate)s (PMMA)s, whose branched architectures resemble the 'dendron' part(s) of dendrimer, were synthesized by an iterative methodology consisting of two reactions in each iteration process: (a) a coupling reaction of u-functionalized, living, anionic PMMA having two tert-butyldimethylsilyloxymethylphenyl(SMP) groups with benzyl bromide(BnBr)-chain-end-functionalized PMMA, and (b) a transformation reaction of the introduced SMP groups into BnBr functionalities. These two reactions, (a) and (b), were repeated three times to afford a series of dendron-like, hyperbranched (PMMA)s up to third generation. Three dendron-like, hyperbranched (PMMA)s different in branched architecture were also synthesized by the same iterative methodology using a low molecular weight, functionalized 1,1-diphenylalkyl anion prepared from sec-BuLi and 1,1-bis(3-tert-butyldime-thylsilyloxymethylphenyl)ethylene in the reaction step (b) in each iterative process. Furthermore, structurally similar, dendron-like, hyperbranched block copolymers could be successfully synthesized by the iterative methodology using $\alpha$-functionalized, living, anionic poly(2-(perfluorobutyl) ethyl methacrylate) (PRfMA) in addition to $\alpha$-functionalized, living PMMA. Accordingly, the resulting block copolymers were comprised of both PMMA and PRfMA segments with different sequential orders. After the block copolymers were cast into films and annealed, their surface structures were characterized by angle-dependent XPS and contact angle measurements. All three samples showed significant segregation and enrichment of PRfMA segments at the surfaces.

기체분리용 금속유기구조체 분리막의 최근 연구 동향 및 성과 (Recent Progress on Metal-Organic Framework Membranes for Gas Separations: Conventional Synthesis vs. Microwave-Assisted Synthesis)

  • 고쿨라크리쉬난 라무;정해권
    • 멤브레인
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    • 제27권1호
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    • pp.1-42
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    • 2017
  • 금속유기구조체(metal-organic framework)는 유기물와 무기물로 구성된 나노다공성 결정물질로서 일정한 세공 구조를 가지고 있다. 합성시 유기 리간드의 다양한 선택이 가능함으로 인해 다양한 세공 사이즈와 물리적/화학적 성질들을 나타내는 금속유기구조체가 가능하다. 이러한 특성들로 인해 다공성 금속유기구조체는 새로운 기체분리용 막 재료로 각광받고 있다. 그러나 고품질의 다결정 금속유기구조체막을 재조하는 것은 상당히 어려운 일인데, 이것은 지지체 표면에 금속유기구조체 결정을 자라게 하는 것이 쉽지 않기 때문이다. 지난 이십여 년 동안 마이크로 전자파를 이용한 물질 합성에 대한 연구가 상당히 진행되었는데 특히 마이크로 전자파를 이용하면 전통적인 합성법에 비해 금속유기구조체 분리막을 제조하는 과정에서의 어려움들을 극복할 수 있다. 마이크로 전자파를 이용한 다결정 분리막 제조 공정은 단시간 합성, 복잡한 구조체 합성 및 나노 결정체 합성 등의 장점이 있다. 본 총설에서는 금속유기구조체 분리막 제조 및 기체 분리에 관한 최근 연구성과들을 살펴보고 특히 마이크로 전자파를 이용한 분리막 제조 공정을 중심으로 정리한다.

SPM을 이용한 유기박막의 전기.광학 이미지 관찰 (Observation of Electrical and Optical Images of Organic Thin Films Using SPM)

  • 유승엽;이승준;진철남;신훈규;권영수
    • 대한전기학회:학술대회논문집
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    • 대한전기학회 1999년도 하계학술대회 논문집 D
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    • pp.1777-1779
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    • 1999
  • SMM is a dynamic noncontact electric force microscopy that allows simultaneous access to the electrical properties of molecular system such as surface potential, surface charge, dielectric constant and conductivity along with the topography. SNOAM is a new tool for surface imaging which was introduced as one application of AFM. Operated with non-contact forces between the optical fiber and sample as well as equipped with the piezoscanners, the instrument reports on surface topology without damaging or modifying the surface for measuring of optical characteristic in the films. Here we report our recent results of its application to nanoscopic study of domain structures and electrical functionality in organic thin films by SMM. Furthermore, we have illustrated the SNOAM image in obtaining the merocyanine dye films as well as the optical image.

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Self-assembly and Mechanism of L-Alanine-based Dihydrazide Derivative as Excellent Gelator of Organic Solvents

  • Wang, Chuan-Sheng;Wang, Xiao-Hong;Li, Zhi-Yuan;Wei, Wei;Shi, Zhong-Liang;Sui, Zhi-Tong
    • Bulletin of the Korean Chemical Society
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    • 제32권4호
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    • pp.1258-1262
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    • 2011
  • A new organogelator, L-Alanine dihydrazide derivative can self-assemble in various organic solvents and turned them into thermally reversible physical supramolecular organogels at extremely low concentrations (< 2 wt %). The gel-sol phase transition temperatures ($T_{GS}$) were determined as a function of gelator concentration and the corresponding enthalpies (${\Delta}H_g$) were extracted. Scanning electron microscopy (SEM) measurements revealed that the interspaces of fiber-like network structures were diminished with the increasing of the LMOG concentration. FT-IR spectroscopy studies revealed that hydrogen-bonding and hydrophobic interaction were the driving forces for the formation of the gels. Based on the data of XRD and molecular modeling, the possible packing modes for the formation of organogelator aggregates were proposed.

AOPWIN을 이용한 Acetanilide의 광부해 특성 평가 (Estimated Photodegradation Properties of Acetanilide Using AOPWIN)

  • 권민정;최윤호;송상환;박혜연;구현주;전성환;나진균;박광식
    • Environmental Analysis Health and Toxicology
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    • 제16권3호
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    • pp.139-142
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    • 2001
  • Acetanilide is a High Production Volume Chemical, which is produced about 2,300 tons/year in Korea as of 1998 survey. Most is used as an intermediate for synthesis of pharmaceuticals and dyes, and the chemical is one of seven chemicals of which human and environmental risk are being assessed by National Institute of Environmental Research under the frame of OECD SIDS program. The Atmospheric Oxidation Program for Microsoft Windows (AOPWIN) is used to estimates the rate constant for the atmospheric, gas-phase reaction between photochemically produced hydroxyl radicals and organic chemicals. It is also used to estimates the rate constant for the gas-phase reaction between ozone and olefinic/acetylenic compounds. The rate constants estimated by the program are then used to calculate atmospheric half-lives for organic compounds based upon average atmospheric concentrations of hydroxyl radicals and ozone. AOPWIN requires only a chemical structure to make these predictions. Structures are entered into AOPWIN by SMILES (Simplified Molecular Input Line Entry System) notations. In this study, one of environmental fate/distribution of the chemical elements, photodegradation of acetanilide was estimated using AOPWIN model based on SMILES notation and chemical name data.

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Fully Organic PIN OLEDs with High Power Efficiency and Long Lifetime for the Use in Display and Lighting Applications

  • Blochwitz-Nimoth, Jan;Birnstock, Jan;Wellmann, Philipp;Werner, Ansgar;Romainczyk, Tilmann;Limmert, Michael;Grubing, Andre
    • 한국정보디스플레이학회:학술대회논문집
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    • 한국정보디스플레이학회 2005년도 International Meeting on Information Displayvol.II
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    • pp.955-962
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    • 2005
  • Power efficiency, lifetime and stable manufacturing processes are the crucial parameters for the success of organic light emitting diodes (OLEDs) in display and lighting applications. Highest power efficiencies of PIN-OLEDs for all principal colours and for bottom and top emission OLED structures have been demonstrated. The PIN structure, which means the incorporation of intentionally doped charge carrier transport layer in a suitable OLED layer setup, lowers the operating voltage to achieve highest power efficiencies. Up to now the n-doping of the electron transport layer has been done by alkali metal co-deposition. This has main draw-backs in terms of manufacturability, since the handling of large amounts of pure Cs is a basic issue in production lines. Here we present in detail results on PIN-OLEDs comprising a newly developed molecular n-dopant. All the previous OLED performance data based on PIN-OLEDs with alkali metal doping could be reproduced and will be further improved in the future. Hence, for the first time, a full manufacturing compatible PIN-OLED is available.

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Temperature and the Interfacial Buffer Layer Effects on the Nanostructure in the Copper (II) Phthalocyanine: Fullerene Bulk Heterojunction

  • Kim, Hyo Jung;Kim, Jang-Joo;Jeon, Taeyeol;Kong, Ki Won;Lee, Hyun Hwi
    • 한국진공학회:학술대회논문집
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    • 한국진공학회 2014년도 제46회 동계 정기학술대회 초록집
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    • pp.275.1-275.1
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    • 2014
  • The effects of the interfacial buffer layer and temperature on the organic bulk heterojunction (BHJ) nanostructures of copper phthalocyanine (CuPc) and fullerene (C60) systems were investigated using real time in-situ x-ray scattering. In the CuPc:C60 BHJ structures, standing-on configured ${\gamma}$-CuPc phase was formed by co-deposition of CuPc and C60. Once formed ${\gamma}$-phase was thermally stable during the annealing upon $180^{\circ}C$. Meanwhile, the insertion of CuI buffer layer prior to deposition of the CuPc:C60 BHJ layer induced lying-down configured CuPc crystals in the BHJ layer. The lying CuPc peak intensity and the lattice parameter were increased by the thermal annealing. This increment of the intensity seemed to be related to the strain at the interface between CuPc:C60 and CuI, which was proportional to the enhancement of the power conversion efficiency of the device.

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Low-Molecular-Weight White Organic-Light-Emitting-Devices using Direct Color Mixing Method

  • Lee, Sung-Soo;Song, Tae-Joon;Ko, Myung-Soo;Cho, Sung-Min
    • Journal of Information Display
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    • 제3권2호
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    • pp.6-12
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    • 2002
  • In order to achieve white emission from organic light emitting devices (OLEDs), five distinct structures were fabricated and tested. The white emission was obtained using two different color-emitting materials (yellow from rubrene-doped $Alq_3$ and blue from DPVBi) with or without a carrier-blocking layer. For enhancing the red emission, two types of devices with three-color emitting materials were fabricated. The white emission, close to the CIE coordinate of (0.3,0.3), was achieved by using two blocking layers as well that as without a blocking layer. This paper covers the subject of controlling the location of exciton recombination zone. It has been found that there is a trade-off in that the devices with three color emitting layers do not show as much luminescence efficiency compared to those with two color emitting layers, but rather, show distinct red emission in the resultant emission spectra. The highest power efficiency was measured to be 1.15lm/W at 2,000 $cd/m^2$ for a structure with two color-emitting layers.