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首页> 外文期刊>International Journal of Quantum Chemistry >New cesium hydrogen selenate phosphates: Synthesis and crystal structures
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New cesium hydrogen selenate phosphates: Synthesis and crystal structures

机译:新型硒酸氢铯磷酸酯:合成与晶体结构

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Three new compounds, Cs-4(SeO4)(HSeO4)(2)(H3PO4) (I), Cs-3(HSeO4)(2)(H2PO4) (II), and Cs-5(HSeO4)(3)(H2PO4)(2) (III), were synthesized from water solutions of CsHSeO4/CsH2PO4. According to X-ray single-crystal analysis, the compounds have the following crystal data: I, monoclinic, space group P2(1), a 5.915(1) Angstrom, b = 13.797(3) Angstrom, c = 11.828(2) Angstrom, beta = 95.11(3)degrees, V = 961.4 Angstrom(3), Z = 2, R-1 = 0.0384; II, monoclinic, space group P2(1), a = 20.281(8) Angstrom, b = 8.039(4) Angstrom, c = 9.160(4) Angstrom, beta = 99.96(4)degrees, V = 1470.9 Angstrom(3), Z = 4, R-1 = 0.0580; III, monoclinic, space group C2/c, a = 33.855(8) Angstrom, b = 7.978(2) Angstrom, c = 9.217(2) Angstrom, beta = 101.00(2)degrees, V = 2443.7 Angstrom(3), Z = 4, R-1 = 0.0519. All three compounds have in common a coordination number of cesium of 10 or 10+1, with Cs-O distances from 2.9 to 3.8 Angstrom. P and Se atoms form the individual tetrahedra with different I-I-bonding connectivity in structures I-III. PO4-SeO4 layers with attached SeO4 groups are present in I. Structure II contains a three-dimensional hydrogen bonding network, whereas structure III is characterized by PO4-SeO4 bands to which additional SeO4 tetrahedra are attached. (C) 1998 Academic Press. [References: 13]
机译:三种新化合物Cs-4(SeO4)(HSeO4)(2)(H3PO4)(I),Cs-3(HSeO4)(2)(H2PO4)(II)和Cs-5(HSeO4)(3)(从CsHSeO4 / CsH2PO4的水溶液中合成H2PO4)(2)(III)。根据X射线单晶分析,这些化合物具有以下晶体数据:I,单斜晶系,空间群P2(1),5.915(1)埃,b = 13.797(3)埃,c = 11.828(2)埃,β= 95.11(3)度,V = 961.4埃(3),Z = 2,R-1 = 0.0384; II,单斜面,空间群P2(1)/ n,a = 20.281(8)埃,b = 8.039(4)埃,c = 9.160(4)埃,beta = 99.96(4)度,V = 1470.9埃( 3),Z = 4,R-1 = 0.0580; III,单斜,C2 / c空间群,a = 33.855(8)埃,b = 7.978(2)埃,c = 9.217(2)埃,beta = 101.00(2)度,V = 2443.7埃(3), Z = 4,R-1 = 0.0519。所有这三种化合物的铯配位数共同为10或10 + 1,Cs-O距离为2.9至3.8埃。 P和Se原子形成结构I-III中具有不同I-I键连接性的单个四面体。 I中存在带有连接的SeO4基团的PO4-SeO4层。结构II包含三维氢键网络,而结构III的特征在于附加了SeO4四面体的PO4-SeO4带。 (C)1998年学术出版社。 [参考:13]

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