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首页> 外文期刊>Polyhedron: The International Journal for Inorganic and Organometallic Chemistry >THE COORDINATION CHEMISTRY OF MIXED PYRIDINEPHENOL AND PHENANTHROLINE-PHENOL LIGANDS - THE CRYSTAL STRUCTURE OF 2-(2-HYDROXYPHENYL)-1,10-PHENANTHROLINE (HL) AND THE CRYSTAL STRUCTURE AND PROPERTIES OF [FEL(2)][PF6]
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THE COORDINATION CHEMISTRY OF MIXED PYRIDINEPHENOL AND PHENANTHROLINE-PHENOL LIGANDS - THE CRYSTAL STRUCTURE OF 2-(2-HYDROXYPHENYL)-1,10-PHENANTHROLINE (HL) AND THE CRYSTAL STRUCTURE AND PROPERTIES OF [FEL(2)][PF6]

机译:苯二酚与苯酚-酚类配位化合物的配位化学-2-(2-羟基苯酚)-1,10-菲咯啉(HL)的晶体结构和[Fel(2)] [PF6]的晶体结构和性质

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摘要

The crystal structures of the N,N,O-terdentate ligand 2-(2-hydroxyphenyl)-1,10-phenanthroline (HL) and its Fe(III) complex [FeL(2)][PF6] (1) have been determined. In HL, an intramolecular O-H ... N hydrogen bond between the phenolic OH and the adjacent nitrogen atom of the phenanthroline fragment constrains these two donor atoms to be cisoid, with the proton 'chelated'. The molecules of HL are associated into pairs in the crystal via a face-to-face aromatic pi-stacking interaction. Complex 1 has a conventional distorted octahedral structure; sections of the aromatic ligands overlap between adjacent molecules to form an interleaved stack. It is high-spin down to 83 K, and its EPR spectrum (frozen glass at 77 K) is entirely typical of a rhombically distorted high-spin Fe-III site. [References: 18]
机译:N,N,O齿状配体2-(2-羟苯基)-1,10-菲咯啉(HL)及其Fe(III)配合物[FeL(2)] [PF6](1)的晶体结构为决心。在HL中,酚OH和邻菲咯啉片段的相邻氮原子之间的分子内O-H ... N氢键将这两个供体原子约束为顺式,质子被“螯合”。 HL分子通过面对面的芳香π堆积相互作用在晶体中成对缔合。配合物1具有常规的扭曲八面体结构;芳族配体的两个部分在相邻分子之间重叠以形成交错的堆叠。它的旋转速度低至83 K,其EPR光谱(77 K的冻结玻璃)完全是菱形扭曲的高旋转Fe-III站点的典型特征。 [参考:18]

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