Weil Matthias
Institute for Chemical Technologies and Analytics, Division of Structural Chemistry, Vienna University of Technology, Getreidemarkt 9/164-SC, A-1060 Vienna, Austria.
Acta Crystallogr Sect E Struct Rep Online. 2009 Mar 19;65(Pt 4):i29. doi: 10.1107/S1600536809009702.
The title compound, octaaqua-(hydrogendifluorido)-di-cop-per(II) hexa-fluoridoaluminate dihydrate, was obtained under hydro-thermal conditions. The structure is isotypic with that of the analogous Fe(III) compound, [Cu(2)(HF(2))(H(2)O)(8)][FeF(6)]·2H(2)O. The coordination sphere of the Cu(II) atom is formed by one F and three water O atoms at short distances < 2 Å and is augmented by two additional water O atoms at significantly longer distances, leading to a considerably distorted octa-hedral environment. By edge-sharing, these octa-hedra form dimeric Cu(2)(HF(2))(H(2)O)(8) units that are bonded to AlF(6) anions ( symmetry) and to crystal lattice water mol-ecules via hydrogen bonds. Besides F-H⋯F inter-actions between the dimeric cationic units, O-H⋯F and O-H⋯O hydrogen bonds (both in part bifurcated) are observed.
标题化合物二水合八水合(二氟氢根)-二铜(II)六氟铝酸盐是在水热条件下得到的。其结构与类似的铁(III)化合物[Cu₂(HF₂)(H₂O)₈][FeF₆]·2H₂O同型。铜(II)原子的配位球由一个氟原子和三个距离较短(<2 Å)的水分子氧原子构成,并通过另外两个距离明显更长的水分子氧原子得到扩展,导致形成一个严重扭曲的八面体环境。通过边共享,这些八面体形成二聚体[Cu₂(HF₂)(H₂O)₈]³⁺单元,它们通过氢键与[AlF₆]³⁻阴离子(对称)和晶格水分子相连。除了二聚阳离子单元之间的F—H⋯F相互作用外,还观察到O—H⋯F和O—H⋯O氢键(部分为分叉氢键)。