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991.
Ingo Rüter Hanskarl Müller-Buschbaum 《Monatshefte für Chemie / Chemical Monthly》1989,120(12):1069-1074
Summary A compound Ba6Nd2Al4O15 with a new structure-type was prepared by solid state reaction. It crystallizes with hexagonal symmetry, space group C
6v
4
– P 63mc;a=11.5696;c=6.9662 Å;z=2. Ba6Nd2Al4O15 has a dominating Ba/O-framework with incorporated AlO6-octahedra and AlO4-tetrahedra. A main feature of the structure are face connected BaO6-octahedra. One of the point positions of the heavy atoms is occupied statistically by Ba2+ and Nd3+. 相似文献
992.
A. A. El-Asmy 《中国化学会会志》1988,35(1):29-34
The preparation and characterization of a series of new coordination compounds of Co(II), Ni(II), Cu(II), Zn(II) and Cd(II) containing o-methyl- or o-chlorobenzoyl-4-phenyl-3-thiosemicarbazide (HMBPT, HCBPT=HL) are reported. The reaction products were investigated by analyses, electrolytic conductance, magnetic susceptibility, reflectance and IR spectral studies. The IR spectra show that HMBPT and HCBPT coordinate with the metal ions via different coordination sites (NS and/or NO). The spectral data support the suggestion that the ligands form his-chelates with Ni(II) and Cu(II) of square planar stereochemistry and of general formulae ML2·H2O, where L is the uninegatively charged bidentate ligand. The Co(II) ion forms octahedral and tetrahedral structures with HMBPT and HCBPT, respectively. The ligand field parameters (D4, B and β) for the Co(II) chelates were calculated using the averaged-ligand-field approximation. The influence of the benzene ring substituents (o-chloro or o-methyl) on the stereochemistry are discussed. Also, the formation of the complexes in solution was tested by the pH-metric method. 相似文献
993.
994.
Fukuji Higashi Khoji Nakajima Wen Xion Zhang 《Journal of polymer science. Part A, Polymer chemistry》1994,32(4):747-752
It is proposed that depression of the transition temperatures, especially the melting point (Tm), can be achieved by the introduction of a different amide bond structure into the copolyamides of dicarboxylic acids and diamines by copolymerization of aminocarboxylic acids, such as p-aminobenzoic acid. The effect was examined by the amount and distribution of the structure in the copolylamindes. Copolycondensations of PEG3, p-aminobenzoic acid, and diamines with different chain lengths showed that the structural change of the amide bond in the copolymers, especially its distribution, was more important than its total amount in them. Several types of aminocarboxylic acids were briefly examined to study the effect. © 1994 John Wiley & Sons, Inc. 相似文献
995.
Three unsymmetrical tetradentate Schiff base ligands, H2salipn, H2salipn-Br4 and H2salipn-Cl2, have been synthesized from the typical condensation reactions of treating 1,2-diaminopropane with salicylaldehyde, 3,5-dibromosalicylaldehyde and 5-chlorosalicylaldehyde, respectively. Treatment of [RuCl2(PPh3)3] with one equivalent of H2salipn or H2salipn-Br4 in the presence of triethylamine in tetrahydrofuran (THF) afforded the corresponding ruthenium(III) complexes [RuIIICl(PPh3)(salipn)] (1) and [RuIIICl(PPh3)(salipn-Br4)] (2). Interaction of [RuHCl(CO)(PPh3)3] with one equivalent of H2salipn-Cl2 or H2salipn-Br4 under the same conditions led to isolation of ruthenium(II) complexes [RuII(CO)(PPh3)(salalipn-Cl2)] (3) and [RuII(CO)(PPh3)(salalipn-Br4)] (4), respectively, in which one of the imine bonds was nucleophilically attacked by hydride to result in the formation of a mixed imine-amine ligand. The molecular structures of 1?1.5CH2Cl2, 2, 3?0.5CH2Cl2 and 4 have been determined by single-crystal X-ray crystallography. The electrochemical properties of 1–4 were also investigated. Their cyclic voltammograms displayed quasi-reversible Ru(IV)/Ru(III) and Ru(III)/Ru(II) couples with Eo ranging from 0.67 to 1.05 V and 0.74 to 0.80 V vs. Ag/AgCl (0.1 M), respectively. 相似文献
996.
Magnetic NiFe particles were synthesized through hydrothermal method using hydrazine as reductant. Composite particles with core-shell structure were further achieved by depositing silicon dioxide generated via carbonation decomposition of sodium silicate solution on the surface of magnetic cores. Characterized by XRD, the Ni9Fe particles are of fcc-type structure, and the structure of magnetic cores in composite particles was maintained despite being covered by SiO2 shell. The existence of SiO2 shells in the composite particles were demonstrated by SEM, EDS and IR. The results from TG and VSM indicated that the shell structure affected the physiochemical properties. The composite particles exhibited remarkable resistance to oxidation in comparison with Ni9Fe particles due to being protected by SiO2 shell. Meanwhile, both of them are soft magnetic materials, but Ms, Mr and Hc in Ni9[email protected]2 particle decreased compared with magnetic NiFe particles. The formation mechanisms of Ni9Fe micro-particles and composite Ni9Fe particles were discussed. 相似文献
997.
Six isotypic R6ZTe2 phases have been synthesized in Ta at elevated temperatures and characterized by single crystal X-ray refinements for R=Y, Z=Rh, Pd, Ag, Y and for R=Lu, Z=Cu, Ag. All crystallize in the Sc6PdTe2-type structure, Pnma, Z=4, a∼21.5 Å, b∼4.1 Å, c∼11.4 Å. The results can be viewed as the replacement of Te3 atoms in the parent isotypic Sc2Te (or in the hypothetical Y2Te or Lu2Te analogues) by the above the Z, the Y example giving the new binary phase Y7Te2. The shorter (and stronger) metal-metal bonds concentrate in the region of metal (Z, Y) substitution, as revealed by larger integrated crystal orbital Hamilton population (ICOHP) values derived from linear muffin-tin-orbital (LMTO) calculations. Partial densities-of-states data for Y7Te2 reflect a similar behavior. Individual R-R bond distances are seen to deviate appreciably from the more fundamental overlap population measures for each. 相似文献
998.
用溶剂热方法合成了[Me4N]2HgGe4S10, 通过单晶X射线衍射, IR, DSC-TG手段对其进行了表征. 结果表明, 标题化合物属四方晶系, I-4空间群, 晶胞参数a=0.92687(8) nm, c=1.43739(12) nm, V=1.23484(18) nm3, Z=2, Mo Kα λ=0.071073 nm, R1=0.0570, wR2=0.1374, 空旷骨架结构由超四面体Ge4S10与HgS4四面体共用顶点连接而成, 有机模板离子在一维孔道中. 该化合物具有一定的热稳定性, 在320 ℃发生分解形成GeS2. 相似文献
999.
PdH2、YH2分子的结构与势能函数 总被引:6,自引:0,他引:6
用密度泛函理论的B3LYP方法,对钯和钇原子采用SDD收缩价基函数,氢原子采用6-311++G**全电子基函数,对PdH2和YH2体系的结构进行优化计算,得到PdH2分子最稳态为C2v构型,电子组态为1A1,平衡核间距RPdH=0.1692 nm,键角∠HPdH=29.4°,离解能De=5.5212 eV,基态简正振动频率:ν1(b2)=1470.1 cm-1、ν2(a1)=1007.9 cm-1、ν3(a1)=2907.0 cm-1.YH2分子最稳态也为C2v构型,电子组态2A1,RYH=0.1962 nm,∠HYH=114.3°,De=5.6691 eV,基态简正振动频率:ν1(b2)=1457.9 cm-1、ν2(a1)=476.0 cm-1、ν3(a1)=1506.3 cm-1.由微观过程的可逆性原理分析了分子的可能离解极限.并用多体项展式理论方法分别导出基态PdH2和YH2分子的势能函数,其等值势能面图准确地再现了PdH2和YH2分子的结构特征和离解能,由此讨论了Pd + H2和Y + H2分子反应的势能面静态特征. 相似文献
1000.
制备了具有Anderson结构的铁钼杂多酸稀土盐,经元素组成分析、TG和ICP确定其通式为Ln[FeMo6O24H6](Ln^3 =La,Ce,Pr,Nd,Sm,Gd,Dy,Yb).采用IR,UV,^95Mo-NMR,XRD等方法进行了结构表征,发现在IR光谱图上呈现出羟基和H2O的两个振动谱带,并进行了归属,表明此类杂多酸稀土盐属Anderson结构B型.借鉴TG-DTA、不同温度下的IR和XRD及水溶性实验对Ln[FeMo6O24H6]和(NH4)3[FeMo6O24H6]的热解性质研究表明,此类杂多酸稀土盐的分解温度为350~400℃.比母体酸盐的热稳定性提高了10℃. 相似文献