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首页> 外文期刊>Chinese Journal of Structural Chemistry >Synthesis and Crystal Structure of a 1-D Coordination Polymer {[Cu(NIT4py)_2(ip)]·6H_2O}_·n
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Synthesis and Crystal Structure of a 1-D Coordination Polymer {[Cu(NIT4py)_2(ip)]·6H_2O}_·n

机译:一维配位聚合物{[Cu(NIT4py)_2(ip)]·6H_2O} _·n的合成及晶体结构

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摘要

A new complex {[Cu(NIT4py)_2(ip)]·6H_2O}_n (NIT4py=2-(4′-pyridinyl)-4,4,5,5-tetra methylimidazoline-1-oxyl-3-oxide and ip = isophthalate dianion) has been synthesized and structurally characterized by X-ray diffraction. It crystallizes in orthorhombic, space group Cmcm with a = 25.161(3), b =10.045(1), c = 15.450(2) A, C_(32)H_(48)N_6O_(14)Cu, M_r = 804.30, V = 3904.8(8) A~3, Z = 4, D_c = 1.368 g/cm~3, μ(MoKα) = 0.630 mm~(-1), F(000) = 1692, the final R = 0.0326 and wR = 0.0787 for 1843 independent reflections with R_(int) = 0.0372. Each Cu(II) ion is four-coordinated by two car-boxylate oxygen atoms and two pyridyl-N atoms from NIT4py radicals to furnish a rhombus geometry. The central Cu(II) ion is located at an inversion center and a crystallographic two-fold axis. Each isophthalate dianion binds two Cu(II) ions in bis-monodentate mode, leading to a 1-D chain, a these 1-D chains are further linked into a 2-D network via hydrogen-bonding interactions.
机译:一个新的络合物{[Cu(NIT4py)_2(ip)]·6H_2O} _n(NIT4py = 2-(4'-吡啶基)-4,4,5,5-四甲基咪唑啉-1-氧基-3-氧化物和ip =间苯二甲酸二阴离子)已经合成并且通过X射线衍射在结构上表征。它在正交晶体空间群Cmcm中结晶,其中a = 25.161(3),b = 10.045(1),c = 15.450(2)A,C_(32)H_(48)N_6O_(14)Cu,M_r = 804.30,V = 3904.8(8)A〜3,Z = 4,D_c = 1.368 g / cm〜3,μ(MoKα)= 0.630 mm〜(-1),F(000)= 1692,最终R = 0.0326和wR =对于R_(int)= 0.0372的1843个独立反射,其值为0.0787。每个Cu(II)离子由NIT4py自由基中的两个羧基氧原子和两个吡啶-N原子四配位,以提供菱形几何形状。中心的Cu(II)离子位于反型中心和晶体学的两倍轴。每个间苯二甲酸二价阴离子以双单齿模式结合两个Cu(II)离子,形成1-D链,这些1-D链通过氢键相互作用进一步连接成2-D网络。

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