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Synthesis and crystal structure of an expanded square grid metal organic material, [Cu(L1)(DMF)] _n· (2.64 DMF)

机译:扩展方格金属有机材料[Cu(L1)(DMF)] _n·(2.64 DMF)的合成和晶体结构

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摘要

A new square grid metal organic material, [Cu(L1)(DMF)] _n· (2.64 DMF) (1; L1= N-(4-carboxyphenyl)-trimellitimide), has been prepared by solvothermal reaction of Cu(NO _3) _2·2.5H _2O, H _2L1, and caffeine in N,Ndimethylformamide (DMF). The title compound crystallizes in the monoclinic crystal system, space group C2/c, with a = 18.5176 (6) ?, b = 23.7473 (7) ?, c = 18.1998 (5) ?, b = 107.527 (2)°, and V = 7631.7 (4) ? ~3. The undulating sheets, formed by linking of Cu _2(μ ~2 -CO _2) _4 square paddlewheel nodes by the angular L1, stack to form large square channels of approximately 11.9 9×11.9 ? ~2 running along the c axis. The geometry and conformation of the linker result in slight distortion of the grids. Further, the 147° bend angle between coordinating moieties of L1 is amenable to forming a diverse array of paddlewheel-based supramolecular isomers.
机译:通过Cu(NO _3)的溶剂热反应制备了一种新型的方格金属有机材料[Cu(L1)(DMF)] _ n·(2.64 DMF)(1; L1 = N-(4-羧基苯基)-三苯甲酰亚胺)。 )N,N二甲基甲酰胺(DMF)中的_2·2.5H _2O,H _2L1和咖啡因。标题化合物在单斜晶系C2 / c空间群中结晶,a = 18.5176(6)θ,b = 23.7473(7)θ,c = 18.1998(5)θ,b = 107.527(2)°,和V = 7631.7(4)? 〜3。通过将Cu _2(μ〜2 -CO _2)_4个方形的桨轮节点连接成角L1而形成的起伏片堆叠以形成大约11.9 9×11.9?的大正方形通道。 〜2沿c轴运行。接头的几何形状和构象会导致栅格轻微变形。此外,L1的配位部分之间的147°弯曲角适于形成多种基于桨轮的超分子异构体。

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