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三水合双(吡啶-2,6-二羧酸根-κO,N,O')铝酸(III)2-(2-吡啶基)吡啶鎓盐

2-(2-Pyrid-yl)pyridinium bis-(pyridine-2,6-dicarboxyl-ato-κO,N,O')aluminate(III) trihydrate.

作者信息

Soleimannejad Janet, Aghabozorg Hossein, Mohammadzadeh Yaghoub, Hooshmand Shabnam

出版信息

Acta Crystallogr Sect E Struct Rep Online. 2008 Jun 7;64(Pt 7):m870-1. doi: 10.1107/S1600536808015973.

Abstract

The title compound, (C(10)H(9)N(2))[Al(C(7)H(3)NO(4))(2)]·3H(2)O or (2,2'-bipyH)[Al(pydc)(2)]·3H(2)O (where 2,2'-bipy is 2,2'-bipyridine and pydcH(2) is pyridine-2,6-dicarboxylic acid), was synthesized by the reaction of aluminium(III) nitrate nona-hydrate with pyridine-2,6-dicarboxylic acid and 2,2'-bipyridine in a 1:2:4 molar ratio in aqueous solution. This compound is composed of an anionic complex, Al(pydc)(2), a protonated 2,2'-bipyridine mol-ecule as a counter-ion, (2,2'-bipyH)(+), and three uncoordinated water mol-ecules. The anion is a six-coordinate complex, with the Al(III) atom in a distorted octa-hedral geometry coordinated by two tridentate pyridine-2,6-dicarboxyl-ate groups. In the crystal structure, inter-molecular O-H⋯O, N-H⋯O, N-H⋯N and C-H⋯O hydrogen bonds, π-π stacking between two aromatic rings [centroid-centroid distance = 3.827 (10) Å], and C=O⋯π stacking [with distances of 3.2311 (13), 3.4924 (14) and 3.5731 (13) Å], connect the various components to form a supra-molecular structure.

摘要

标题化合物(C₁₀H₉N₂)[Al(C₇H₃NO₄)₂]·3H₂O 或(2,2'-联吡啶H)[Al(吡啶-2,6-二羧酸)₂]·3H₂O(其中2,2'-联吡啶为2,2'-联吡啶,吡啶-2,6-二羧酸H₂为吡啶-2,6-二羧酸),通过硝酸铝九水合物与吡啶-2,6-二羧酸和2,2'-联吡啶以1:2:4的摩尔比在水溶液中反应合成。该化合物由阴离子配合物[Al(吡啶-2,6-二羧酸)₂]⁻、作为抗衡离子的质子化2,2'-联吡啶分子(2,2'-联吡啶H)⁺和三个未配位的水分子组成。阴离子是六配位配合物,Al(III)原子处于扭曲的八面体几何构型,由两个三齿吡啶-2,6-二羧酸盐基团配位。在晶体结构中,分子间的O-H⋯O、N-H⋯O、N-H⋯N和C-H⋯O氢键、两个芳香环之间的π-π堆积[质心-质心距离 = 3.827 (10) Å]以及C=O⋯π堆积[距离分别为3.2311 (13)、3.4924 (14)和3.5731 (13) Å],将各种组分连接形成超分子结构。

https://cdn.ncbi.nlm.nih.gov/pmc/blobs/fd44/2961889/522d82ce8b3a/e-64-0m870-fig1.jpg

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