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首页> 外文期刊>International Journal of Quantum Chemistry >Synthesis of open-framework iron phosphates, [C5N2H14](2)[(Fe2F2)-F-III(HPO4)(4)]center dot 2H(2)O and [C5N2H14][Fe-4(III) (H2O)(4)F-2(PO4)(4)], with one- and three-dimensional structures
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Synthesis of open-framework iron phosphates, [C5N2H14](2)[(Fe2F2)-F-III(HPO4)(4)]center dot 2H(2)O and [C5N2H14][Fe-4(III) (H2O)(4)F-2(PO4)(4)], with one- and three-dimensional structures

机译:开骨架磷酸铁[C5N2H14](2)[(Fe2F2)-F-III(HPO4)(4)]中心点2H(2)O和[C5N2H14] [Fe-4(III)(H2O)的合成(4)F-2(PO4)(4)],具有一维和三维结构

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The hydrothermal syntheses and structures of two new open-framework iron phosphates, [C5N2H14](2)[(Fe2F2)-F-III(HPO4)(4)] (.) 2H(2)O, I, and [C5N2H14][Fe-4(III)(H2O)(4)F-2(PO4)(4)], II, are presented. While the structure of I consist of FeO4F2 octahedra and HPO4 terahedra linked to form one-dimensional structure, that of II consist of FeO4(H2O)(2), FeO4(H2O)(2), FeO4F2 and PO4 units connected to give rise to a three-dimensional structure. The structure of I resembles the naturally occurring mineral tancoite while 11 resembles the iron phosphate, ULM-12, [C6N2H14][Fe-4(PO4)(2)F-2(H2O)(3)]. Magnetic susceptibility studies indicate anti-ferromagnetic behavior in both the compounds with T-N-200 and 175K for I and II, respectively. Crystal data: I, monoclinic, space group-P2(1) (no. 14). a = 7.2261(6) b = 16.5731(14), c = 11.0847(10) Angstrom, beta = 97.265(2)degrees, V = 1316.8(2) Angstrom(3), Z = 41, rho(calc) = 1.952g cm(-1), mu((MoKa)) = 1.446mm(-1), R-1 = 0.0448 and wR(2) = 0.1141 for 1882 data [I>2sigma(I)]; for II, monoclinic, space group = P2(1) (no. 14). a = 9.9691(3) b = 12.4013(3), c = 17.3410(3) Angstrom, beta = 103.762(1)degrees, V = 2082.32(9) Angstrom(3), Z = 4, rho(calc) = 2.576g cm(-1), mu((MoKalpha)) = 3.162 mm(-1), R-1 = 0.0510 and wR(2) = 0.1064 for 2979 data [I > 2sigma(I)]. (C) 2003 Elsevier Inc. All rights reserved.
机译:[C5N2H14](2)[(Fe2F2)-F-III(HPO4)(4)](。)2H(2)O,I和[C5N2H14]的两种新型开放骨架磷酸铁的水热合成和结构提出了[Fe-4(III)(H2O)(4)F-2(PO4)(4)] II。 I的结构由连接成一维结构的FeO4F2八面体和HPO4的四面体组成,而II的结构由相连的FeO4(H2O)(2),FeO4(H2O)(2),FeO4F2和PO4单元组成三维结构。 I的结构类似于天然存在的矿物锰矿,而11的结构类似于磷酸铁ULM-12,[C6N2H14] [Fe-4(PO4)(2)F-2(H2O)(3)]。磁化率研究表明,在I和II分别具有T-N-200和175K的两种化合物中,其抗铁磁性能均良好。晶体数据:I,单斜晶系,空间群-P2(1)/ n(第14号)。 a = 7.2261(6)b = 16.5731(14),c = 11.0847(10)埃,beta = 97.265(2)度,V = 1316.8(2)埃(3),Z = 41,rho(calc)= 1.952 g厘米(-1),mu((MoKa))= 1.446mm(-1),R-1 = 0.0448,wR(2)= 0.1141,用于1882年数据[I> 2sigma(I)];对于II,单斜,空间群= P2(1)/ n(第14号)。 a = 9.9691(3)b = 12.4013(3),c = 17.3410(3)埃,beta = 103.762(1)度,V = 2082.32(9)埃(3),Z = 4,rho(calc)= 2.576 g cm(-1),mu((MoKalpha))= 3.162 mm(-1),R-1 = 0.0510和wR(2)= 0.1064,用于2979个数据[I> 2sigma(I)]。 (C)2003 Elsevier Inc.保留所有权利。

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