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Synthesis and characterization of a novel layered zinc phosphate

机译:新型层状磷酸锌的合成与表征

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The syntheses and crystal structures of a novel layered zinc phosphate and its high temperature variant are described. Both structures were solved from powder diffraction data using both synchrotron and conventional X-ray radiation. The as-synthesized material (UiO-27-as) with composition (C_6H_(17)N_3)~(2+) (Zn_3(HPO_4)(PO_4)_2)~(2-) centre dot H_2O crystallizes in the space group P2_1/c with a = 12.67072(15), h = 8.24293(8), C = 18.48425(l9) A, #beta# = 109.1346(7)o and V = 1823.904(35) A~3. The zinc phosphate layers are built from corner sharing hexameric secondary building units. In the interlamellar space there are organic cations and water molecules. A high temperature variant exists around 200 deg C (UiO-27-200). This compound (C_6H_(17)N_3)~(2+)(HZn_3(PO_4)_3)~(2-) crystallizes in the monoclinic space group P2_1/C with a = 12.29010(23), b = 8.39995(13), C= 18.49914(30) A, #beta# = 114.2504(11) deg and V = 1741.261(51) A~3. The transformation to UiO-27-200 involves removal of the interlamellar water molecules. The atomic arrangement within the zinc phosphate layers is maintained; however, the layers are brought closer which leads to inter-layer hydrogen bonding interactions.
机译:描述了新型层状磷酸锌的合成,晶体结构及其高温变体。两种结构均使用同步加速器和常规X射线辐射从粉末衍射数据中求解。组成为(C_6H_(17)N_3)〜(2+)(Zn_3(HPO_4)(PO_4)_2)〜(2-)中心位置H_2O的合成材料(UiO-27-as)在空间组P2_1中结晶/ c,其中a = 12.67072(15),h = 8.24293(8),C = 18.48425(19)A,#beta#= 109.1346(7)o,V = 1823.904(35)A〜3。磷酸锌层由角共享六聚体二级构建单元构建。在层间空间中,存在有机阳离子和水分子。大约200摄氏度(UiO-27-200)存在高温变体。该化合物(C_6H_(17)N_3)〜(2 +)(HZn_3(PO_4)_3)〜(2-)在单斜空间群P2_1 / C中结晶,a = 12.29010(23),b = 8.39995(13), C = 18.49914(30)A,#beta#= 114.2504(11)度,并且V = 1741.61(51)A〜3。向UiO-27-200的转化涉及去除层间水分子。维持磷酸锌层内的原子排列;然而,这些层变得更紧密,这导致层间氢键相互作用。

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