• 제목/요약/키워드: chemical shift

검색결과 890건 처리시간 0.025초

In situ Photoacoustic Study of Water Gas Shift Reaction over Magnetite/Chromium Oxide and Copper/Zinc Oxide Catalysts

  • Byun, In-Sik;Choi, Ok-Lim;Choi, Joong-Gill;Lee, Sung-Han
    • Bulletin of the Korean Chemical Society
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    • 제23권11호
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    • pp.1513-1518
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    • 2002
  • Kinetic studies on the water-gas shift reaction catalyzed by magnetite/chromium oxide and copper/zinc oxide were carried out by using an in situ photoacoustic spectroscopic technique. The reactions were performed in a closed-circulation reactor system using a differential photoacoustic cell at total pressure of 40 Torr in the temperature range of 100 to $350^{\circ}C.$ The CO2 photoacoustic signal varying with the concentration of CO2 during the catalytic reaction was recorded as a function of time. The time-resolved photoacoustic spectra obtained for the initial reaction stage provided precise data of CO2 formation rate. The apparent activation energies determined from the initial rates were 74.7 kJ/mol for the magnetite/chromium oxide catalyst and 50.9 kJ/mol for the copper/zinc oxide catalyst. To determine the reaction orders, partial pressures of CO(g) and H2O(g) in the reaction mixture were varied at a constant total pressure of 40 Torr with N2 buffer gas. For the magnetite/chromium oxide catalyst, the reaction orders with respect to CO and H2O were determined to be 0.93 and 0.18, respectively. For the copper/zinc oxide catalyst, the reaction orders with respect to CO and H2O were determined to be 0.79 and 0, respectively.

Secondary structure analysis of MRA1997 from Mycobacterium tuberculosis and characterization of DNA binding property

  • Kim, Hyo Jung;Lee, Ki-Young;Kim, Yena;Kwon, Ae-Ran;Lee, Bong-Jin
    • 한국자기공명학회논문지
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    • 제20권2호
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    • pp.36-40
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    • 2016
  • MRA1997 is a highly conserved protein from mycobacterial strains. However, no structural and functional information is associated with it. Thus, to obtain details about structure and function of this protein, we have utilized NMR spectroscopy. The recombinant MRA1997 was highly purified and its DNA binding mode was characterized. The tertiary structure of MRA1997 was modeled on the basis of our NMR chemical shift data combined with the webserver CS23D. The binding of MRA1997 with DNA was first monitored by electrophoresis mobility shift assays. The residues involved in DNA binding are identified using NMR chemical shift perturbation experiments. Based on our study, we suggest that MRA1997 interacts with DNA and may play an important role in Mycobacterium tuberculosis physiology.

톨루엔과 요오드 사이의 전하이동착물에 대한 압력의 영향 (I) (The Effect of Pressures on the Formation of Charge Transfer Complexes of Toluene with Iodine (I))

  • 권오천
    • 대한화학회지
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    • 제19권2호
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    • pp.73-84
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    • 1975
  • 톨루엔과 요오드 사이의 전하이동착물의 안정도에 미치는 압력과 온도의 영향을 n-헥산용액에서 자외선 분광광도법으로 연구하였다. 압력은 1에서 1,200bar, 온도는 $25^{\circ}C$에서 $60^{\circ}C 사이에서 측정하였다. 착물의 평형상수는 압력 및 온도의 증가와 더불어 증가 및 감소하고 흡수계는 대체로 증가함을 알았다. 이들 각 평형정수로부터 착물 형성에 따른 부피, 엔탈피, 자유에너지 및 엔트로피 변화 양을 구하였다. 또한 압력의 증가에 의한 blue-shift현상 및 압력 변화에 의한 진동자 세기와의 관계를 열역학적 함수와 관계지워 설명하였다

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ZnO 나노막대의 표면이 광학적 특성에 미치는 영향 (The Effect of the ZnO Nanorod Surface on the Optical Property)

  • 조현민;이석주;조재원
    • 한국전기전자재료학회논문지
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    • 제23권2호
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    • pp.93-97
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    • 2010
  • We have studied the effect of the chemical composition of the ZnO nanorod surface on the optical characteristics. The surface was treated with H- and O-plasma at different surface temperatures. The chemical composition of the surface of the ZnO nanorod, being investigated by Auger Electron Spectroscopy(AES), was related to the Photoluminescence(PL) data reported in our previous results. The AES showed the opposite results for the $H_2$ and $O_2$ plasma treatments. The ratio of Zn to O on the surface of the ZnO nanorod increased in the case of $H_2$ plasma, while the composition rate of O increased after $O_2$ plasma treatment. The AES results seems to be correlated to the shift in PL peaks. The increase in the composition rate of Zn on the surface of ZnO nanorod is considered to cause the blue shift of the UV peak. On the contrary, the relative increase of O is considered to cause the red shift in PL peaks.

The Study on the Physicochemical Properties of Fluid under High Pressure (Ⅱ). The Effect of Pressure and Temperature on the Hexamethyl Benzene-Iodine Charge Transfer Complex in n-Hexane

  • 권오천;김정림
    • Bulletin of the Korean Chemical Society
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    • 제6권4호
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    • pp.186-191
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    • 1985
  • The effect of pressure and temperature on the stabilities of the charge transfer complexes of hexamethyl benzene with iodine in n-hexane has been investigated by UV-spectrophotometric measurements. In this experiment the absorption spectra of mixed solutions of hexamethyl benzene and iodine in n-hexane were measured at 25, 40 and $60^{\circ}C$ under 1,200, 600, 1200 and 1600 bar. The equilibrium constant of the complex formation was increased with pressure while being decreased with temperature raising. Changes of volume, enthalpy, free energy and entropy for the formation of the complexes were obtained from the equilibrium constants. The red shift at higher pressure, the blue shift at higher temperature and the relation between pressure and oscillator strength were discussed by means of thermodynamic functions. In comparison with the results in the previous studies, it can be seen that the pressure dependence of oscillator strength has a extremum behavior in durene as the variation of ${\Delta}H$ or ${\Delta}S$ with the number of methyl groups of polymethyl benzene near atmospheric pressure in the previous study. The shift or deformation of the potential in the ground state and in the excited state of the complexes formed between polymethyl benzene and iodine was considered from the correlation between the differences of the electron transfer energies and the differences of free energies of the complex formation for the pressure variation.

Aluminum Borate 화합물에 있어서 EU2+이온의 발광성 (A Fundamental Study of Eu2+ Luminescence in Aluminum Borate Compounds)

  • 장기석
    • 대한화학회지
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    • 제44권4호
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    • pp.350-355
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    • 2000
  • 알루미늄 보레이트 화합물, $CaAl_2(BO_3)_2O$$BaAl_2(BO_3)_2O$은 매우 효과적으로 $Eu^{2+}$ 이온의 형광성을 나타내는 발광격자를 가지고 있다. 발광피크는 $Eu^{2+}$:$CaAl_2(BO_3)_2O$화합물에 있어서 450㎚이고 $Eu^{2+}$:$SrAl_2(BO_3)_2O$화합물에 있어서411㎚이며 $Eu^{2+}$:$BaAl_2(BO_3)_2O$ 화합물에 있어서 375㎚이다. 그러므로 $Eu^{2+}$:$CaAl_2(BO_3)_2O$ 화합물은 파란색을 내는 좋은 형광체이며, 특별히, 진공자외선 제논 플라마스 램프에 있어서 우수한 형광물질로 기대된다. $Eu^{2+}$ 이온은 PDP 형광체로써 관심이 높으며, Stokes shift는 형광물질의 도핑격자 크기에 의해서 결정이 된다. Stokes shift는 발광 파장을 결정하는 하나의 중요한 요소이다. 만일, 도핑격자의 크기가작아짐에 따라 $Eu^{2+}$ 이온의 5d 에너지 준위가 낮아지면, 발광 파장은 길어지고 Stokes shift크기는 커진다. 그러므로 결정격자의 크기를 측정하면 $Eu^{2+}$ 이온의 Stokes shift와 5d 에너지 준위 등의 발광성질을 예측할 수 있다.

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Tailoring the Excited-State Intramolecular Proton Transfer (ESIPT) Fluorescence of 2-(2'-Hydroxyphenyl)benzoxazole Derivatives

  • Seo, Jang-Won;Kim, Se-Hoon;Park, Sang-Hyuk;Park, Soo-Young
    • Bulletin of the Korean Chemical Society
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    • 제26권11호
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    • pp.1706-1710
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    • 2005
  • The excited-state intramolecular proton transfer (ESIPT) fluorescence in the 2-(2'-hydroxyphenyl)benzoxazole (HBO) derivatives with different electron donor and acceptor substituents was studied by spectroscopic and theoretical methods. Changes in the electronic transition, energy levels, and orbital diagrams of HBO analogues were investigated by the semi-empirical molecular orbital calculation and were correlated with the experimental spectral position of ESIPT keto emission. It was found that the presence of substituents, regardless of their nature, resulted in the red-shifted absorption relative to HBO. However, the spectral change of the ESIPT fluorescence was differently affected by the nature of substituent: hypsochromic shift with electron donor and bathochromic shift with electron acceptor.

유기물 박막에서 일어나는 친핵성 반응에 대한 연구 (Study on the nucleophilic reaction on Orgniac Thin Films)

  • 오데레사;김홍배
    • 한국전기전자재료학회:학술대회논문집
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    • 한국전기전자재료학회 2006년도 추계학술대회 논문집 Vol.19
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    • pp.170-171
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    • 2006
  • The chemical shift of SiOC film was observed according to the flow rate ratio. SiOC film has the broad main band of $880{\sim}1190cm^{-1}$ and the sharp Si-$CH_3$ bond at $1252cm^{-1}$, and the infrared spectra in the Si-O-C bond moved to low frequency according to the increasing of an oxygen flow rate. The chemical shift affected the carbon content in the SiOC film, and the decreasing of carbon atoms elongated the C-H bonding length, relatively. The main bond without the sharp Si-$CH_3$ bond at $1252cm^{-1}$ consisted of Si-C, C-O and Si-O bonds, and became the bonding structure of the Si-O-C bond.

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The Magnetic Resonance (MR) Imaging Features of Myxoid Liposarcoma Arising from the Mesentery: a Case Report

  • Ahn, Taehoon;Lee, Young Hwan;Lee, Guy Mok;Kim, Youe Ree;Yoon, Kwon-Ha
    • Investigative Magnetic Resonance Imaging
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    • 제21권4호
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    • pp.252-258
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    • 2017
  • Primary mesenteric liposarcoma is rare. It is difficult to make an accurate preoperative diagnosis of the myxoid type of liposarcoma by using imaging such as ultrasound or computed tomography (CT) due to the very small amount of fat that is located in the tumor. We report a case of primary myxoid liposarcoma of the mesentery which was difficult to differentiate from other solid mesenteric tumors with a myxoid component such as low grade fibromyxoid sarcoma, myxoid leiomyosarcoma or myxoma. Use of chemical shift magnetic resonance (MR) imaging to detect small fat components and its cystic appearance with solid components on the MR images can be useful to differentiate myxoid liposarcoma from the other mesenteric tumors with a myxoid component.

Light Modulation-전자상자성공명법을 이용한 절대속도상수의 결정 (The Absolute Rate Measurement by Light Modulation-ESR Technique)

  • 주광열
    • 대한화학회지
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    • 제21권4호
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    • pp.270-275
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    • 1977
  • Modulated light signal과 trimethylsilyl 유리기의 전자상자성 공명 signal과의 phase shift를 측정함으로써 t-butoxy 유리기와 trimethylsilane의 절대 반응속도 상수는 $-50^{\circ}C$에서 $3{\times}10^{-2}M^{-1}{\cdot}sec^{-1}$으로 얻을 수 있었다.

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