首页> 美国卫生研究院文献>Acta Crystallographica Section E: Crystallographic Communications >Crystal structure of an AgI inter­calation compound: catena-polysilver(I)-μ-N-(pyridin-3-ylmeth­yl)pyridin-3-amine-κ2N:N′ hexa­fluorido­phosphate aceto­nitrile disolvate
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Crystal structure of an AgI inter­calation compound: catena-polysilver(I)-μ-N-(pyridin-3-ylmeth­yl)pyridin-3-amine-κ2N:N′ hexa­fluorido­phosphate aceto­nitrile disolvate

机译:AgI嵌入化合物的晶体结构:链-聚银(I)-μ-N-(吡啶-3-基甲基­基)吡啶-3-胺-κ2N:N六氟氟磷酸乙腈二溶剂化物

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摘要

The asymmetric unit in the title compound, [Ag(C11H11N3)]PF6·2CH3CN or {[AgL]·PF6·2CH3CN}n, L = N-(pyridin-3-ylmeth­yl)pyridin-3-amine, comprises one AgI atom, one L ligand, two aceto­nitrile solvent mol­ecules and one PF6 anion disordered over two orientations in a 0.567 (11):0.433 (11) ratio. Each AgI atom is coordinated by two pyridine N atoms from two L ligands in a slightly distorted linear coordination geometry [N—Ag—N = 170.55 (8)°]. Each L ligand bridges two AgI ions, resulting in the formation of a zigzag chain propagating along the [101] direction. In the crystal, Ag⋯Ag contacts [3.3023 (5) Å] and inter­molecular π–π stacking inter­actions [centroid-to-centroid distance = 3.5922 (15) Å] between the pyridine rings link these chains into a corrugated layer parallel to the (01) plane. The layers are stacked with a separation of 10.4532 (5) Å, and aceto­nitrile solvent mol­ecules and PF6 anions as guests are inter­calated between the layers. The layers are connected through several N/C—H⋯F hydrogen bonds and P—F⋯π inter­actions [F⋯ring centroid = 3.241 (8) Å] between the layer and the inter­calated guests and between the inter­calated guests, forming a three-dimensional supra­molecular network.
机译:标题化合物[Ag(C11H11N3)] PF6·2CH3CN或{[AgL]·PF6·2CH3CN} n中的不对称单元,L = N-(吡啶-3-基甲基)吡啶-3-胺,包括一个Ag < sup> I 原子,一个L配体,两个乙腈溶剂分子和一个PF6 -阴离子在两个方向上无序排列,比例为0.567(11):0.433(11)。每个Ag I 原子都被来自两个L配体的两个吡啶N原子配位,线性配位几何[N-Ag-N = 170.55(8)°]稍微变形。每个L配体桥接两个Ag I 离子,从而形成沿[101]方向传播的之字形链。在晶体中,Ag⋯Ag接触[3.3023(5)Å],吡啶环之间的分子间π-π堆积相互作用[质心间的距离= 3.5922(15)Å]将这些链连接成平行于(01)飞机。这些层以10.4532(5)的间距堆叠,并且当客体插入层之间时,乙腈溶剂分子和PF6 -阴离子。层之间通过几个N / C-H⋯F氢键和P-F⋯π相互作用[F⋯ring质心= 3.241(8)Å]在层与插层客人之间以及插层客人之间连接,形成三个维超分子网络。

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