• 제목/요약/키워드: Chemical structure analysis

검색결과 1,786건 처리시간 0.032초

X-ray crystal structure of two-dimensional bimetallic host clathrate with 2-aminoethanol, [Cd{NH2CH2CH2OH}2Ni(CN)4]·3C6H5NH2·H2O

  • Kim, Chong-Hyeak;Moon, Hyoung-Sil;Lee, Sueg-Geun
    • 분석과학
    • /
    • 제21권6호
    • /
    • pp.562-568
    • /
    • 2008
  • A novel two-dimensional cadmium(II)-nickel(II) bimetallic host clathrate, $[Cd{NH_2CH_2CH_2OH}_2Ni(CN)_4]{\cdot}3C_6H_5NH_2{\cdot}H_2O$, 1, has been synthesized and structurally characterized by X-ray single crystallographic method. The clathrate 1 crystallizes in the monoclinic system, space group $P2_1/c$ with a = 14.370(3), b = 7.728(1), c = 28.172(4) ${\AA}$, ${\beta}=97.58(1)^{\circ}$, V = 3101.1(9) ${\AA}^3$, Z = 4. The host framework of the clathrate 1 is built of the cyanide bridges between octahedral Cd(II) atom and square planar Ni(II) atom. The octahedral Cd atoms ligated by two 2-aminoethanol molecules and four cyanide ligands bridged with square planar Ni atoms. The Ni atoms bridges to four Cd atoms via cyanides is made up of puckered quadrangles of composition $\{CdNi(CN)_2\}_2$, all edges are shared. This cyanide bridges form an infinite two-dimensional host networks stacking along b axis. 2-Aminoethanol ligands bond to Cd atom through N atom as a monodentate ligand in the axial position and four cyanides take an equatorial plane with all in trans-configurations. The aniline guest molecules and water molecules are located in between the host layer sheets, respectively.

($\eta^{6}$-Mesitylene) manganese-(Ⅰ) Tricarbonyl hexafluorophosphate를 사용한 Pseudomonas Alcaligenes 5S rRNA의 고차원 구조 분석 (Analysis of Higher Order Structure of 5S rRNA from Pseudomonas Alcaligenes by using($\eta^{6}$-mesitylene) manganese-(Ⅰ) Tricarbonyl hexafluorophosphate)

  • 김상범;박인원
    • 대한화학회지
    • /
    • 제42권2호
    • /
    • pp.209-213
    • /
    • 1998
  • (η6-mesitylene) manganese (Ⅰ) tricarbonyl hexafluorophosphate[MTH-Mn (Ⅰ)]과 황산 이메틸, 피로탄산 이에틸, 과망간산 칼륨 따위 화학탐침들을 사용하여 Pseudomonas alcaligenes 5S rRNA의 고차원 구조를 분석하였다. 5S rRNA의 삼차구조에서 MTH-Mn (Ⅰ)이 강하게 절단하는 자리들은 a고리의 $G_{12}AUGG_{16}$, b-C 구역의 3'쪽 가닥, 즉$G_{51}AAGUGAAGC_{60}$, B-a구역의 $U_{65}-AGCG_{69}$, d고리의 5'쪽 가닥의 $G_{72}AUGG_{76}$ 연속부분 들이다. MTH-Mn(Ⅰ)과 그밖의 화학 탐침들을 사용하여 얻은 절단 양식들에서 우리는, MTH-Mn(Ⅰ)으로 강하게 절단되는 연속부분들이 $tRNA^{Phe}$의 L자 구조의 모서리 부분에서와 같은 주머니 구조를 이룰 것이며, 이러한 구조를 형성할 때 b-C구역과 d고리가 돌쩌귀 구실을 하는 것으로 추정한다.

  • PDF

3D-foam 구조의 구리-주석 합금 도금층을 음극재로 사용한 리튬이온배터리의 전기화학적 특성 평가 (Electrochemical Properties of 3D Cu-Sn Foam as Anode for Rechargeable Lithium-Ion Battery)

  • 정민경;이기백;최진섭
    • 한국표면공학회지
    • /
    • 제51권1호
    • /
    • pp.47-53
    • /
    • 2018
  • Sn-based lithium-ion batteries have low cost and high theoretical specific capacity. However, one of major problem is the capacity fading caused by volume expansion during lithiation/delithiation. In this study, 3-dimensional foam structure of Cu-Sn alloy is prepared by co-electrodeposition including large free space to accommodate the volume expansion of Sn. The Cu-Sn foam structure exhibits highly porous and numerous small grains. The result of EDX mapping and XPS spectrum analysis confirm that Cu-Sn foam consists of $SnO_2$ with a small quantity of CuO. The Cu-Sn foam structure electrode shows high reversible redox peaks in cyclic voltammograms. The galvanostatic cell cycling performances show that Cu-Sn foam electrode has high specific capacity of 687 mAh/g at a current rate of 50 mA/g. Through SEM observation after the charge/discharge processes, the morphology of Cu-Sn foam structure is mostly maintained despite large volume expansion during the repeated lithiation/delithiation reactions.

Ownership Structure and Firm Performance: Evidence from Pharmaceutical and Chemical Industry of Bangladesh

  • SOBHAN, Raihan
    • Asian Journal of Business Environment
    • /
    • 제12권4호
    • /
    • pp.35-44
    • /
    • 2022
  • Purpose: The main purpose of this study is to find out the impact of ownership structure on firm performance in the pharmaceutical and chemical industry of Bangladesh. Research design, data and methodology: The study has been conducted on 28 listed pharmaceutical and chemical companies from 2012 to 2020. Return on Assets (ROA) and Tobin's Q are selected as indicators of internal and market performance of the firms respectively whereas institutional ownership, directors' ownership and foreign ownership are selected as proxies of ownership structure. Panel analysis using random effects, lag method and time dummy method is used to analyse the relationship. Results: The study has found the existence of highly concentrated directors' ownership, a low percentage of institutional ownership and a very insignificant proportion of foreign ownership in the industry. The regression results show that directors' ownership has a positive and significant impact on firm performance, supporting the concept of agency theory. The study has also found a positive and significant impact of foreign ownership on firm performance. Unfortunately, the impact of institutional ownership is found to be insignificant. Conclusions: Directors' ownership and foreign ownership decreases agency cost that ultimately increases firm performance. However, the role of institutional investors is not significant enough to improve firm performance. It is suggested that institutional investors should be more active and involved in monitoring the activities of the organisations to improve performance.

SiOC 박막의 화학적 특성과 전기적인 특성에 대한 차이점에 관한 연구 (Study on the Different Characteristic of Chemical and Electronic Properties)

  • 오데레사
    • 한국진공학회지
    • /
    • 제18권1호
    • /
    • pp.49-53
    • /
    • 2009
  • 층간 절연막으로써 연구되고 있는 SiOC 박막의 화학적 변화에 대하여 살펴보았다. SiOC 박막의 형성은 알킬기와 수산기에 의한 극성분자의 조합에 의해 무분극성의 박막을 형성할 수 있고 무분극성에 의한 비정질 구조를 형성함으로써 유전상수의 감소를 유도할수 있다. 박막의 화학적인 특성은 이온의 변화에 의한 결정구조의 변화로 결정할수 있고, 화학적인 변화의 분석은 FTIR에 의한 탄소함량변화로부터 무분극성의 영역을 유추해 내었다. 전기적인 특성은 박막 내에서의 전자의 특성을 알아보는 것으로써 화학적인 특성과 반드시 일치하는 것은 아니다 유량변화에 따른 SiOC 박막의 전기적인 특성을 분석함으로써 화학적 특성의 변화와 어느 정도 상관성이 있는지를 조사하였다. SiOC 박막은 열처리 후 대체로 누설전류가 증가하는 것으로 나타났고 특히 탄소의 함량이 급격히 증가하는 샘플이 존재하였다. 그러나 탄소의 함량이 증가하였으나 누설전류는 상대적으로 작게 나타나는 것으로 보아 화학적인 관점에서 탄소의 증가는 박막의 구조변화에 따른 효과로 직접 전류에 기여하지 않는다고 볼 수 있다.

AFM and Specular Reflectance IR Studies on the Surface Structure of Poly(ethylene terephthalate) Films upon Treatment with Argon and Oxygen Plasmas

  • Seo, Eun-Deock
    • Macromolecular Research
    • /
    • 제12권1호
    • /
    • pp.134-140
    • /
    • 2004
  • Semi-crystalline poly(ethylene terephthalate) (PET) film surfaces were modified with argon and oxygen plasmas by radio-frequency (RF) glow discharge at 240 mTorr/40 W; the changes in topography and surface structure were investigated by atomic force microscopy (AFM) in conjunction with specular reflectance of infrared microspectroscopy (IMS). Under our operating conditions, analysis of the AFM images revealed that longer plasma treatment results in significant ablation on the film surface with increasing roughness, regardless of the kind of plasma used. The basic topographies, however, were different depending upon the kind of gas used. The specular reflectance analysis showed that the ablative mechanisms of the argon and oxygen plasma treatments are entirely different with one another. For the Ar-plasma-treated PET surface, no observable difference in the chemical structure was observed before and after plasma treatment. On the other hand, the oxygen-plasma-treated PET surface displays a significant decrease in the number of aliphatic C-H groups. We conclude that a constant removal of material from the PET surface occurs when using the Ar-plasma, whereas preferential etching of aliphatic C-H groups, with respect to, e.g. , carbonyl and ether groups, occurs upon oxygen plasma.

Synthesis and Characterization of New Organotin (IV)-phenylenebisdithiocarbamate Complexes

  • Lee, Won-Ho;Jung, Ok-Sang;Sohn, Youn-Soo;Kim, Poong-Zag
    • Bulletin of the Korean Chemical Society
    • /
    • 제7권6호
    • /
    • pp.421-425
    • /
    • 1986
  • New di- and triorganotin(IV) complexes of meta- and para-phenylenebisdithiocarbamate(m- and p-pbdtc) have been synthesized and characterized by means of chemical analysis, mass spectrometry, and IR spectroscopy. The reaction of the m-pbdtc ligand with diorganotin(IV) halides resulted in 1:1 products, $R_2Sn{\cdot}m$-pbdtc (R = Me, Cy, n-Bu) of dimeric nature whereas the p-pbdtc ligand led to an oligomeric or polymeric structure. The pbdtc ligands were also reacted with triorganotin(IV) halides to form monomeric complexes, $(R_3Sn)_2{\cdot}pbdtc.$ The tin coordination chemistry of these complexes were also discussed in terms of Sn-C and Sn-S bonding modes.

Electronic Structure and Bonding in the Ternary Silicide YNiSi3

  • Sung, Gi-Hong;Kang, Dae-Bok
    • Bulletin of the Korean Chemical Society
    • /
    • 제24권3호
    • /
    • pp.325-333
    • /
    • 2003
  • An analysis of the electronic structure and bonding in the ternary silicide YNiSi₃is made, using extended Huckel tight-binding calculations. The YNiSi₃structure consists of Ni-capped Si₂dimer layers and Si zigzag chains. Significant bonding interactions are present between the silicon atoms in the structure. The oxidation state formalism of $(Y^{3+})(Ni^0)(Si^3)^{3-}$ for YNiSi₃constitutes a good starting point to describe its electronic structure. Si atoms receive electrons from the most electropositive Y in YNiSi₃, and Ni 3d and Si 3p states dominate below the Fermi level. There is an interesting electron balance between the two Si and Ni sublattices. Since the ${\pi}^*$ orbitals in the Si chain and the Ni d and s block levels are almost completely occupied, the charge balance for YNiSi₃can be rewritten as $(Y^{3+})(Ni^{2-})(Si^{2-})(Si-Si)^+$, making the Si₂layers oxidized. These results suggest that the Si zigzag chain contains single bonds and the Si₂double layer possesses single bonds within a dimer with a partial double bond character. Strong Si-Si and Ni-Si bonding interactions are important for giving stability to the structure, while essentially no metal-metal bonding exists at all. The 2D metallic behavior of this compound is due to the Si-Si interaction leading to dispersion of the several Si₂π bands crossing the Fermi level in the plane perpendicular to the crystallographic b axis.

A Noninjection Reaction Route to CuInSe2 Nanocrystals with Triethanolamine as the Complexing Agent

  • Liu, Wen-Long;Wu, Meng-Qiang;Zhou, Ru-Chao;Yan, Li-Dan;Zhang, Shu-Ren;Zhang, Qi-Yi
    • Bulletin of the Korean Chemical Society
    • /
    • 제32권12호
    • /
    • pp.4332-4336
    • /
    • 2011
  • The chalcopyrite-type $CuInSe_2$ is a remarkable material for thin film solar cells owing to its electronic structure and optical response. Single-phase sphere-like $CuInSe_2$ nanocrystallite particles were prepared by a facile noninjection method with triethanolamine as the complexing agent and the solvent simultaneously. The period of the reaction was the key to form single-phase $CuInSe_2$ nanocrystals at $240^{\circ}C$. TEM, XRD, XPS, EDX investigations were performed to characterize the morphology and the detailed structure of as-synthesized $CuInSe_2$ nanocrystals. All of the analysis results proved that the synthesized nanocrystals were pure phase and close to the stoichiometric ratio rather than a simple mixture. The band gap of the obtained $CuInSe_2$ nanocrystals was $1.03{\pm}0.03$ eV.

경사 데토네이션파의 근사 해석 모델과 비정상 상세구조 (Approximate Analysis Model and Detailed Unsteady Structure of Oblique Detonation Waves)

  • 최정열;김동완
    • 한국추진공학회:학술대회논문집
    • /
    • 한국추진공학회 2005년도 제25회 추계학술대회논문집
    • /
    • pp.136-140
    • /
    • 2005
  • 일차원 ZND 데토네이션 구조 해석 모델의 연장선상에서 경사 충격파와 경사 데토네이션 파에 대하여 Rankine-Hugoniot 관계식과 반응속도를 연계한 이차원 경사 데토네이션 파의 구조해석 모델을 제시하였다. 이에 기반을 두어 삼중점, 횡단 충격파 및 셀 구조를 포함하는 경사 데토네이션 파의 비정상 상세 구조를 조사하기 위한 이차원 유체역학 해석을 수행하였다. 전산 유체 해석 결과는 경사 데토네이션 파의 상세구조에 대한 깊이 있는 이해를 제공하며, 해석 모델은 경사 데토네이션 파를 연소 메커니즘으로 이용하는 극초음속 추진기관의 통합 설계도구로 이용될 수 있을 것이다.

  • PDF