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首页> 外文期刊>Acta Crystallographica, Section B. Structural Science >Structures of homoleptic benzyl derivatives of zirconium
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Structures of homoleptic benzyl derivatives of zirconium

机译:锆均苯甲基衍生物的结构

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Crystals of Zr(P-CH2C6H4CMe3)(4), tetra(4-tert-butylbenzyl)zirconium (1), have been studied by X-ray diffraction. The crystals belong to the tetragonal system, space group I (4) over bar, with a = 16.481 (2), c = 7.131(4) Angstrom, so that chemically equivalent ligands are also structurally equivalent, unlike other known homoleptic M(CH2C6H5)(4) compounds. Zr-CH2-C-ipso bond angles of 90.0(2)degrees suggest that ligands are eta(2)-bonded. The structure is discussed along with that of Zr(CH2C6H5)4, tetrabenzylzirconium (2) (redetermined), which is crystallographically unsymmetrical but also of approximate S-4 symmetry. The distortion of (2) from tetragonal symmetry (the four Zr-CH2-C-ipso bond angles being rather different) is discussed along with crystal packing. [References: 37]
机译:通过X射线衍射研究了Zr(P-CH2C6H4CMe3)(4)的晶体四(4-叔丁基苄基)锆(1)。晶体属于四方晶系,在bar上属于空间群I(4),a = 16.481(2),c = 7.131(4)埃,因此化学等效的配体在结构上也是等效的,这与其他已知的均相M(CH2C6H5)不同)(4)化合物。 Zr-CH2-C-ipso键角为90.0(2)度,表明配体是eta(2)键合的。讨论了该结构以及Zr(CH2C6H5)4四苄基锆(2)(已确定)的结构,该晶体在晶体学上不对称,但也具有近似S-4对称性。讨论了(2)的四方对称变形(四个Zr-CH2-C-ipso键角相当不同)以及晶体堆积。 [参考:37]

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