首页> 外文期刊>International Journal of Quantum Chemistry >The First Open-Framework Cadmium Phosphate, K_4[Cd_3(HPO_4)_4(H_2PO_4)_2],with a Layered Structure
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The First Open-Framework Cadmium Phosphate, K_4[Cd_3(HPO_4)_4(H_2PO_4)_2],with a Layered Structure

机译:第一个开放式骨架磷酸镉K_4 [Cd_3(HPO_4)_4(H_2PO_4)_2],具有分层结构

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A layered cadmium phosphate of the formula K_4[Cd_3(HPO_4)_4(H_2PO_4)_2], I, containing six-membered apertures, constituting the first example of an open-framework cadmium phosphate , has been synthesized under hydrothermal conditions, Crystal data: monoclinic P2_1(No.14),a=9.0698(3),b=6.7341(3),and c=18.2663(7)A, #beta#=93.092(1),V=1114.03A~3, Z=4.The structure consists of a network of CdO_3 octahedra and PO_3(OH) and PO_2(OH)_2 tetrahedra forming a spiro unit, which are connected through Cd_2O_2 two-membered rings forming one-dimenional chains .The chains are further connceted forming two-dimensional macroanionic layers with six-membered apertures possessing hanging phosphate units on either side of the layer. The layers are stabilized by strong hydrogen bond interactions between the terminal P-OH proups forming pseudo channels in which the charge-compensating extraframework K~+ ions are locatedl The presence of the spiro unit and the infinite one-dimensional Cd-O-Cd chains, along with the hanging phosphates are noteworthy structural features
机译:在水热条件下合成了分子式为K_4 [Cd_3(HPO_4)_4(H_2PO_4)_2] I的层状磷酸镉,该结构包含六元孔,构成开架式磷酸镉的第一个实例,晶体数据:单斜P2_1 / n(14号),a = 9.0698(3),b = 6.7341(3),c = 18.2663(7)A,#beta#= 93.092(1),V = 1114.03A〜3,Z = 4。该结构由CdO_3八面体和PO_3(OH)和PO_2(OH)_2四面体形成螺环单元的网络组成,它们通过Cd_2O_2两元环连接而形成一维链。具有六元孔的二维宏观阴离子层,在该层的任一侧均具有悬挂的磷酸酯单元。通过末端P-OH突触之间的强氢键相互作用来稳定各层,形成伪通道,其中存在电荷补偿性额外骨架K〜+离子。螺环单元和无限一维Cd-O-Cd链的存在,以及悬挂的磷酸盐是值得注意的结构特征

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