• 제목/요약/키워드: Octahedral structure

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Diaquabis(ethylenediamine)nickel(II) Bis(p-toluenesulfonate) Monohydrate 층상 화합물의 합성과 구조 분석 (Synthesis and Structural Analysis of the Diaquabis(ethylenediamine)nickel(II) Bis(p-toluenesulfonate) Monohydrate)

  • 김종혁;이석근
    • 분석과학
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    • 제15권3호
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    • pp.317-320
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    • 2002
  • The layer structure of the title compound, $[Ni(en)_2(H_2O)_2](CH_3C_6H_4SO_3)_2(H_2O)$ (en = ethylenediamine), consists of discrete cations, anions, and solvate water molecules linked by a hydrogen bonding network. The central Ni atom of the cation layer has a slightly distorted octahedral coordination geometry with the ethylenediamine ligands functioning as a N,N'-bidentate and the water ligands bonding through oxygen in a trans arrangement. The p-toluenesulfonate of the anion layer has an alternate sulfonate group directed toward opposite side of the cation layer. This layer structure is stabilized by a hydrogen bond involving the O atoms of the sulfonate, the water ligand, solvate water molecule, and the N atoms of the ethylenediamine.

티오시아네이트 및 4-메틸이미다졸 리간드로 구성된 1차원 카드뮴(II) 착물의 합성과 구조 분석 (Synthesis and Structural Characterization of the One-Dimensional Cadmium(II) Complex with Thiocyanate and 4-Methylimidazole Ligands)

  • 문형실;김종혁;이석근
    • 분석과학
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    • 제14권6호
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    • pp.535-539
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    • 2001
  • One-dimensional coordination polymer of cadmium(II) complex, $[Cd(SCN)_2(C_4H_6N_2]_n$, has been prepared and characterized by X-ray single crystallography. Structure analysis reveals that each cadmium(II) atom is six-coordinated in distorted octahedral fashion with $CdS_2N_4$ composition. $CdS_2N_4$ composition contains two S and two N atoms from four thiocyanates and tow N atoms from two 4-methylimidazole ligands. Central cadmium(II) atoms are run in parallel to the a-axis and are doubly bridged with neighboring cadmium(II) atoms by the thiocyanate and isothiocyanate ligands. Thus, this complex has a one-dimensional polymer structure in which the 4-methylimidazole is in the trans conformation.

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Structural Investigation of the Hydrolysis-Condensation Process of Modified Titanium Isopropoxide

  • Jung, M. W.;Oh, H. J.;Yang, J. C.;Shul, Y. G.
    • Bulletin of the Korean Chemical Society
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    • 제20권12호
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    • pp.1394-1398
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    • 1999
  • The structures of modified Ti$(OPr^i)_4$ with chelating ligands (L) such as ethylacetoacetate (Etac), acetylacetone (Acac) and methylacetoacetate (Mtac) were identified by using IR, ¹H NMR and $^13C$ NMR spectroscopies, and the octahedral structure was confirmed after modification. The pre-edge peaks of XANES spectra of modified metal alkoxides also denoted the mixture of five-fold and six-fold structures. The EXAFS fitting results showed the local structure around Ti atom after alkoxide modification. The hydrolysis-condensation rates of modified Ti alkoxide with organic additives were investigated by ¹H NMR spectroscopy. The Ti$(OPr^i)_4$ modified by Acac was less reactive toward hydrolysis-condensation reaction than those modified by the other alkoxides, which can be attributed to the stable ligand structure between Ti$(OPr^i)_4$ and Acac. The small particle size of modified Ti$(OPr^i)_4$ sol was obtained when Acac was employed.

Structural, Magnetic, and Optical Studies on Normal to Inverse Spinel Phase Transition in FexCo3-xO4 Thin Films

  • Kim, Kwang-Joo;Kim, Hee-Kyung;Park, Young-Ran;Ahn, Geun-Young;Kim, Chul-Sung;Park, Jae-Yun
    • 한국자기학회지
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    • 제15권2호
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    • pp.96-99
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    • 2005
  • Phase transition from normal- to inverse-spinel structure has been observed for $Fe_xCo_{3-x}O_4$ thin films as the Fe composition (x) increases from 0 to 2. The samples were fabricated as thin films by sol-gel method on Si(100) substrates. X-ray diffraction measurements revealed a coexistence of two phases, normal and inverse spinel, for $0.76{\le}x{\le}0.93$. The normal-spinel phase is dominant for $x{\le}0.55$ while the inverse-spinel phase for $x{\ge}l.22$. The cubic lattice constant of the inverse-spinel phase is larger than that of the normal-spinel phase. For both phases the lattice constant increases with increasing x. X-ray photoelectron spectroscopy measurements revealed that both $Fe^{2+}$ and $Fe^{3+}$ ions exist with similar strength in the x=0.93 sample. Conversion electron $M\ddot{o}ssbauer$ spectra measured on the same sample showed that $Fe^{2+}$ ions prefer the octahedral $Co^{3+}$ sites, indicating the formation of the inverse-spinel phase. Analysis on the measured optical absorption spectra for the samples by spectroscopic ellipsometry indicates the dominance of the normal spinel phase for low x in which $Fe^{3+}$ ions tend to substitute the octahedral sites.

Synthesis and Characterization of Group VI Metal Carbonyl Complexes Containing closo-1,2-$(PPh_2)_2$-1,2-$C_2B_1_0H_1_0$ and Their Conversion to Metal Carbene Complexes

  • 박영일;김세진;고재정;강상욱
    • Bulletin of the Korean Chemical Society
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    • 제18권10호
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    • pp.1061-1066
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    • 1997
  • The complexes M(CO)4-1,2-(PPh2)2-1,2-C2B10H10 (M=Cr 2a, Mo 2b, W 2c) have been prepared in good yields from readily available bis-diphenylphosphino-o-carboranyl ligand, closo-1,2-(PPh2)2-1,2-C2B10H10 (1), by direct reaction with Group Ⅵ metal carbonyls. The infrared spectra of the complexes indicate that there is an octahedral disposition of chelate bis-diphenylphosphino-o-carboranyl ligand around the metal atom. The crystal structure of 2a was determined by X-ray diffraction. Complex 2a crystallizes in the monoclinic space group P21/n with cell parameters a = 12.2360(7), b = 17.156(1), c = 16.2040(6) Å, V = 3354.1(3) Å3, and Z =4. Of the reflections measured a total of 2514 unique reflections with F2 > 3σ(F2) was used during subsequent structure refinement. Refinement converged to R1 = 0.066 and R2 = 0.071. Structural studies showed that the chromium atom had a slightly distorted pseudo-octahedral configuration about the metal center with two phosphine groups of o-carborane occupying the equatorial plane cis-orientation to each other. These metal carbonyl complexes are rapidly converted to the corresponding metal carbene complexes, [(CO)3M=C(OCH3)(CH3)]-1,2-(PPh2)2-1,2-C2B10H10 (M= Cr 3a, Mo 3b, W 3c), via alkylation with methyllithium followed by O-methylation with CF3SO3CH3.

아민기로 관능화된 마그네슘-층상규산염을 이용한 섬유유연제 제조 (Preparation of Fabric Softener Product by using Amine-functionalized Magnesium-phyllosilicates)

  • 김성열;최유성
    • 공업화학
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    • 제30권5호
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    • pp.580-585
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    • 2019
  • 본 연구에서는 (3-aminopropyl)triethoxysilane을 사용하여 표면을 아민기로 관능화함과 동시에 팔면체와 사면체 구조를 가지는 마그네슘-층상규산염(AF-MgP)을 합성하였다. FT-IR과 XRD 분석을 통해 AF-MgP가 성공적으로 합성되었음과, 입자 표면의 아민기 및 1 : 2 비율의 팔면체와 사면체 구조를 확인하였다. HR-SEM와 EDX 분석을 통해 면섬유 표면에 AF-MgP가 고루 흡착되어 섬유를 코팅하고 있음을 확인하였다. KS 규격에 따른 섬유의 항균력 시험 결과 AF-MgP 입자가 코팅된 면섬유는 피부 상재균에 대해 매우 우수한 항균 활성을 나타내는 것을 확인하였다. 이상의 결과들은 AF-MgP가 섬유에 항균성을 부여해주는 기능성 나노 소재로서 적용될 뿐만 아니라, 화장품이나 의료 소재 분야에서 응용이 가능함을 시사한다.

화학적 공침법을 이용한 침상형 페라이트 합성 (Preparation and Characterization of Nanocrystalline Spinel Ferrites by Chemical Co-precipitation)

  • ;임윤희;조영민
    • 공업화학
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    • 제22권2호
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    • pp.185-189
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    • 2011
  • 본 연구에서는 화학적 공침법을 적용하여 가스상 이산화탄소 분해를 위한 나노크기의 M-페라이트(M=Co, Ni, Cu, Zn)를 제조하였다. 열중량 분석 결과, 시험제조한 모든 시료의 최고 무게 감소율은 $350^{\circ}C$ 미만에서 발생하였다. 소성온도가 증가할수록 결정형은 우수하여 표면촉매활성화를 기대할 수 있지만, 입자결정의 크기가 크고, 비표면적이 낮은 페라이트가 합성됨을 알 수 있었다. FT-IR 분석으로부터 $375{\sim}406cm^{-1}$의 범위에서 octahedral site에 착화물이 존재함을 확인 할 수 있었으며, 이는 페라이트 내 스피넬 구조가 형성되어 있음을 보여주는 것이라고 믿는다. 본 연구로부터 얻은 이산화탄소 분해반응을 위한 금속페라이트의 최적 열처리 온도는 $500^{\circ}C$인 것으로 나타났다.

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
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    • 제21권6호
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    • pp.562-568
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    • 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.

A Combined Rietveld Refinement on the Crystal Structure of a Magnetoelectric Aurivillius Phase $Bi_5Ti_3FeO_{15}$ Using Neutron and X-ray Powder Diffractions

  • Ko, Tae-Gyung;Jun, Chang-Ho;Lee, Jeong-Soo
    • The Korean Journal of Ceramics
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    • 제5권4호
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    • pp.341-347
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    • 1999
  • An ambiguity on the correct room temperature structure of $Bi_5Ti_3FeO_{15}$ was resolved using a combined Rietveld refinement of neutron and X-ray diffraction. The structure of this compound has been reported to have a space group of F2mm (adopting 2-fold rotation symmetry along the c-axis) or A21am. However, our diffraction, study reveals that some reflections would violate F-centering and confirm that the belong to $A2_1$am. Out refinement with the space group of $A2_1$am converged at $R_p=6.85%, R_wp=9.23%$ and $\chi^2$=1.66 for an isotropic temperature model with 85 variables. The lattice constants are a=5.4677(1) $\AA$, b=5.4396(1) $\AA$, and c=41.2475(8)$\AA$. In structure, Ti/Fe atoms at the oxygen octahedral sites of the perovskite unit are completely disordered, resulting in that these atoms are transparent in neutron diffraction. The octahedra of the perovskite unit are relatively displaced along the a-axis against the Bi atoms, which contribute as a major component to the spontaneous polarization of $Bi_5Ti_3FeO_{15}$.

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Huntite-borate결정의 격자상수 산출을 위한 계산식의 도출 (An empirical formula for the calculation of lattice parameters of the huntite-borate crystals)

  • ;;윤대호
    • 한국결정성장학회지
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    • 제8권1호
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    • pp.91-96
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    • 1998
  • Huntite 구조를 갖는 borate결정의 격자상수($a_0$$c_0$ ) 산출을 위해 특정관계를 갖는 계산식을 도출하였다. 이를 위해 서로 다른 28종류의 조성을 갖고 있는 결정을 사용하였다. 이와 같은 계산식은 huntite 구조내에 위치하는 이온의 평균 반경을 함수로 하여 미지의 조성을 갖고 있는 결정으로부터 격자상수를 예상하는데 사용될 수 있다.

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