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[硝酸钆(Ⅳ)(水)₄]·2H₂O的重新测定

Redetermination of [Gd(NO₃)₃(H₂O)₄]·2H₂O.

作者信息

Taha Ziyad A, Ajlouni Abdulaziz, Hijazi Ahmed K, Kühn Fritz E, Herdtweck Eberhardt

机构信息

Department of Applied Chemical Sciences, Jordan University of Science & Technology, Irbid 22110, Jordan.

出版信息

Acta Crystallogr Sect E Struct Rep Online. 2012 Jul 1;68(Pt 7):i56-i57. doi: 10.1107/S1600536812028000. Epub 2012 Jun 27.

Abstract

The crystal structure of the title compound, tetra-aqua-tris-(nitrato-κ²O,O')gadolinium(III) dihydrate, was redetermined from single-crystal X-ray data. In comparison with the first determination [Ma et al. (1991 ▶). Wuji Huaxue Xuebao, 7, 351-353], all H atoms could be located, accompanied with higher accuracy and precision. The Gd(III) atom shows a ten-coordination with three nitrate ligands behaving in a bidentate manner and the other positions being occupied by four water mol-ecules, forming a distorted bicapped square anti-prism. Two nitrate ions coordinate to the metal atom with similar bond lengths while the third shows a more asymmetric bonding behaviour. An intricate network of O-H⋯O hydrogen bonds, including the lattice water mol-ecules, stabilizes the crystal packing.

摘要

通过单晶X射线数据重新测定了标题化合物三水合三(硝酸根-κ²O,O')钆(III)二水合物的晶体结构。与首次测定[Ma等人(1991 ▶)。《无机化学学报》,7,351 - 353]相比,所有氢原子均可定位,且精度更高。钆(III)原子呈十配位,三个硝酸根配体以双齿方式配位,其他位置被四个水分子占据,形成一个扭曲的双帽四方反棱柱。两个硝酸根离子与金属原子以相似的键长配位,而第三个则表现出更不对称的键合行为。包括晶格水分子在内的O - H⋯O氢键的复杂网络稳定了晶体堆积。

https://cdn.ncbi.nlm.nih.gov/pmc/blobs/29d9/3393141/bf1438ca2f2b/e-68-00i56-fig1.jpg

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