首页> 美国卫生研究院文献>Acta Crystallographica Section E: Crystallographic Communications >Crystal structure of an eight-coordinate terbium(III) ion chelated by NN′-bis­(2-hy­droxy­benz­yl)-NN′-bis­(pyridin-2-ylmeth­yl)ethyl­enedi­amine (bbpen2−) and nitrate
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Crystal structure of an eight-coordinate terbium(III) ion chelated by NN′-bis­(2-hy­droxy­benz­yl)-NN′-bis­(pyridin-2-ylmeth­yl)ethyl­enedi­amine (bbpen2−) and nitrate

机译:NN-双­(2-羟基苄基)-NN-双­(吡啶-2-基甲基­基)乙基­二胺(bbpen2-)和硝酸盐螯合的八配位ter离子的晶体结构

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摘要

The reaction of terbium(III) nitrate penta­hydrate in aceto­nitrile with N,N′-bis­(2-hy­droxy­benz­yl)-N,N′-bis­(pyridin-2-ylmeth­yl)ethyl­enedi­amine (H2bbpen), previously deprotonated with tri­ethyl­amine, produced the mononuclear compound [N,N′-bis­(2-oxidobenzyl-κO)-N,N′-bis­(pyridin-2-ylmethyl-κN)ethylenedi­amine-κ2 N,N′](nitrato-κ2 O,O′)terbium(III), [Tb(C28H28N4O2)(NO3)]. The mol­ecule lies on a twofold rotation axis and the TbIII ion is eight-coordinate with a slightly distorted dodeca­hedral coordination geometry. In the symmetry-unique part of the mol­ecule, the pyridine and benzene rings are both essentially planar and form a dihedral angle of 61.42 (7)°. In the mol­ecular structure, the N4O4 coordination environment is defined by the hexa­dentate bbpen ligand and the bidentate nitrate anion. In the crystal, a weak C—H⋯O hydrogen bond links mol­ecules into a two-dimensional network parallel to (001).
机译:五水合硝酸ter(III)在乙腈中与预先用三乙胺去质子化的N,N'-双(2-羟基苄基)-N,N'-双(吡啶-2-基甲基)乙二胺(H2bbpen)反应生成单核化合物[N,N'-双(2-氧化苄基-κO)-N,N'-双(吡啶-2-基甲基-κN)乙二胺-κ 2 N,N'](硝基- κ 2 O,O')ter(III),[Tb(C28H28N4O2)(NO3)]。分子位于双重旋转轴上,Tb III 离子为八坐标,十二面体配位几何结构稍有变形。在分子的对称唯一部分中,吡啶环和苯环均基本为平面,并形成61.42°(7)°的二面角。在分子结构中,N4O4配位环境由六齿的bbpen配体和二齿的硝酸根阴离子定义。在晶体中,弱的CHHO氢键将分子连接成与(001)平行的二维网络。

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