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Synthesis, Crystal Structure, and N2-Adsorption Property of a Chain Complex of Rhodium(II) Benzoate and Piperazine

机译:苯甲酸铑(II)和哌嗪的链配合物的合成,晶体结构和N2-吸附性能

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The title compound, an adduct of rhodium(II) benzoate [Rh2(bz)4] with piperazine (pip), catena(tetrakis(μ-benzoato-O,O′)(μ-piperazine-N,N′)dirhodium(II)-acetonitrile (1/2)) [Rh2(bz)4(pip)]n·2nCH3CN, was isolated, and the crystal structure was determined by the single-crystal X-ray diffraction method at 90 K. It crystallizes in the triclinic space group P1 with a = 10.812(2)Å, b = 11.393(3)Å, c = 15.331(3)Å, α = 71.014(5)°, β = 87.063(5)°, γ = 76.451(5)°, V = 1734.4(8)Å3, Dx = 1.644 g/cm3, and Z = 2. The R1 [I 2σ(I)] and wR2 (all data) values are 0.0558 and 0.1367, respectively, for all 6986 independent reflections. The crystal contains zigzag chain molecules with an alternating arrangement of Rh2(bz)4 [Rh-Rh 2.4010(10), 2.4066(10)Å] and piperadine, and acetonitrile molecules. The adsorption property was confirmed for N2 with a specific surface area of 52.7 m2/g.
机译:标题化合物,是苯甲酸铑(II)[Rh 2 (bz) 4 ]与哌嗪(pip),链烯(四(μ -benzoato- O , O ')(μ-哌嗪- N , N < / i>')二铑(II)-乙腈(1/2))[Rh 2 (bz) 4 (pip)] n <分离出/ i> ·2 n CH 3 CN,并通过单晶X射线衍射法在90 K下确定晶体结构。它在三面体空间群 P 1中结晶,其中 a = 10.812(2)Å, b = 11.393(3)Å, c = 15.331(3)Å,α = 71.014(5)°,β = 87.063(5)°,γ = 76.451(5)°, V = 1734.4(8)Å 3 , D x = 1.644 g / cm 3 ,并且 Z =2。 R 1 [ I ( I )]和 wR 2(所有数据)的值分别为0.0558和0.1367。晶体包含 zigzag 链分子,其中Rh 2 (bz) 4 交替排列[Rh-Rh 2.4010(10),2.4066(10 )Å],哌啶和乙腈分子。证实了N 2 的吸附性能,其比表面积为52.7m 2 / g。

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