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Crystal Structure of a Lantern-Type Dirhodium(II) Complex with a cis-(2:2) Arrangement of Two Formamidinato and Two Trifluoroacetato Bridges

机译:具有两个Formamidinato和两个Trifluoroacetato桥的顺式(2:2)排列的灯笼型Dirhodium(II)配合物的晶体结构

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The title compound of a lantern-type rhodium(II) dinuclear complex, cis-[Rh2(3,5-Me2-pf)2(O2CCF3)2(H2O)2]·0.5C6H14 (3,5-Me2-pf- = N,N′-bis(3,5-dimethylphenyl)formamidinate anion), 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 = 11.4725(16)Å, b = 12.4679(17)Å, c = 16.113(2)Å, α = 77.391(2)°, β = 75.265(2)°, γ = 85.548(2)°, V = 2174.6(5)Å3, Dx = 1.548 g/cm3, and Z = 2. The R1 [I 2σ(I)] and wR2 (all data) values are 0.0275 and 0.0625, respectively, for all 9465 independent reflections. The cis-(2:2) arrangement of the 3,5-Me2-pf and trifluoroacetato ligands within the dinuclear core was confirmed, the axial sites of the dimer being occupied by the water molecules. The Rh-Rh distance is 2.4538(4)Å and the axial Rh-O (H2O) distances are 2.3309(16) and 2.3196(16)Å.
机译:灯笼型铑(II)双核配合物标题化合物顺式-[Rh 2 (3,5-Me 2 -pf ) 2 (O 2 CCF 3 2 (H 2 O)< sub> 2 ]·0.5C 6 H 14 (3,5-Me 2 -pf - = N , N '-双(3,5-二甲基苯基)甲ami酸根阴离子),并通过单晶X射线确定晶体结构衍射法在90 K时结晶。它在三斜晶空间群 P 1中结晶,其中 a = 11.4725(16)Å, b = 12.4679(17 )Å, c = 16.113(2)Å,α = 77.391(2)°,β = 75.265(2)°,γ = 85.548(2)°, V = 2174.6(5)Å 3 , D x = 1.548 g / cm 3 ,而 Z =2。 R 1 [ I σ( I )]和 wR 2(所有数据)的值分别为0.0275和0.0625。确认了3,5-Me 2 -pf和三氟乙酰基配体在双核核内的 cis -(2:2)排列,二聚体的轴向位点为被水分子占据。 Rh-Rh距离为2.4538(4)Å,轴向Rh-O(H 2 O)距离为2.3309(16)和2.3196(16)Å。

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