Rukiah Mwaffak, Assaad Thaer
Department of Chemistry, Atomic Energy Commission of Syria (AECS), PO Box 6091, Damascus, Syrian Arab Republic.
Acta Crystallogr C. 2013 Aug;69(Pt 8):815-8. doi: 10.1107/S0108270113016491. Epub 2013 Jul 9.
The title two-dimensional coordination polymer, [Na(C₂H₈NO₆P₂)]n, was characterized using powder X-ray diffraction data and its structure refined using the Rietveld method. The asymmetric unit contains one Na⁺ cation and one (1-azaniumylethane-1,1-diyl)bis(hydrogen phosphonate) anion. The central Na⁺ cation exhibits distorted octahedral coordination geometry involving two deprotonated O atoms, two hydroxy O atoms and two double-bonded O atoms of the bisphosphonate anion. Pairs of sodium-centred octahedra share edges and the pairs are in turn connected to each other by the biphosphonate anion to form a two-dimensional network parallel to the (001) plane. The polymeric layers are connected by strong O-H∙∙∙O hydrogen bonding between the hydroxy group and one of the free O atoms of the bisphosphonate anion to generate a three-dimensional network. Further stabilization of the crystal structure is achived by N-H∙∙∙O and O-H∙∙∙O hydrogen bonding.
二维配位聚合物[Na(C₂H₈NO₆P₂)]n通过粉末X射线衍射数据进行表征,并使用Rietveld方法对其结构进行精修。不对称单元包含一个Na⁺阳离子和一个(1-氮鎓基乙烷-1,1-二基)双(氢膦酸酯)阴离子。中心Na⁺阳离子呈现扭曲的八面体配位几何构型,涉及双膦酸酯阴离子的两个去质子化O原子、两个羟基O原子和两个双键O原子。以钠为中心的八面体对共享棱边,这些对又通过双膦酸酯阴离子相互连接,形成平行于(001)平面的二维网络。聚合物层通过羟基与双膦酸酯阴离子的一个游离O原子之间的强O-H∙∙∙O氢键连接,形成三维网络。晶体结构通过N-H∙∙∙O和O-H∙∙∙O氢键进一步稳定。