Katinaitė Judita, Harrison William T A
Department of Chemistry, University of Aberdeen, Meston Walk, Aberdeen AB24 3UE, Scotland.
Acta Crystallogr E Crystallogr Commun. 2017 Apr 28;73(Pt 5):759-762. doi: 10.1107/S2056989017005758. eCollection 2017 May 1.
The solution-mediated synthesis and crystal structure of 1,1-di-methyl-hydrazinium tetra-phoshonoatotrizincate, (CHN)[Zn(HPO)], are described. The anionic [Zn(HPO)] framework is built up from alternating ZnO tetra-hedra and HPO pseudo-pyramids to generate a three-dimensional 4,3-net encapsulating the CHN cations. The organic cations, which are protonated at their central N atoms, occupy pores delineated by large 16-membered polyhedral rings and inter-act with the framework by way of N-H⋯O hydrogen bonds and possible C-H⋯O inter-actions. One of the zinc ions lies on a crystallographic twofold rotation axis and all the other atoms lie on general positions. The crystal studied was found to be rotationally twinned about the [001] axis in reciprocal space in a 0.585 (5):0.415 (5) ratio.
描述了1,1 - 二甲基肼四膦酸三锌盐(CH₆N₂)[Zn₃(HPO₄)₃]的溶液介导合成及其晶体结构。阴离子[Zn₃(HPO₄)₃]骨架由交替的ZnO四面体和HPO假金字塔构成,形成一个三维的4,3 - 网络,包裹着CH₆N₂阳离子。在其中心N原子处质子化的有机阳离子占据由大的16元多面体环界定的孔,并通过N - H⋯O氢键和可能的C - H⋯O相互作用与骨架相互作用。其中一个锌离子位于晶体学二重旋转轴上,所有其他原子位于一般位置。研究发现所研究的晶体在倒易空间中围绕[001]轴以0.585 (5):0.415 (5)的比例发生旋转孪晶。