Assoumatine Tokouré, Stoeckli-Evans Helen
Institute of Chemistry, University of Neuchâtel, Av. de Bellevax 51, CH-2000 Neuchâtel, Switzerland.
Institute of Physics, University of Neuchâtel, rue Emile-Argand 11, CH-2000 Neuchâtel, Switzerland.
Acta Crystallogr E Crystallogr Commun. 2020 Jun 2;76(Pt 7):984-989. doi: 10.1107/S2056989020007161. eCollection 2020 Jul 1.
The reaction of the hexa-thia-pyrazino-phane ligand, 2,5,8,11,14,17-hexa-thia-9.9-pyrazino-phane (), with copper(II) dibromide led to the formation of a binuclear complex, [μ-2,5,8,11,14,17-hexa-thia-9.9-pyrazino-phane]bis-[bromi-docopper(II)] dibromide, [CuBr(CHNS)]Br, (). The complex possesses inversion symmetry with the pyrazine ring being situated about a center of symmetry. The ligand coordinates to the copper(II) atom in a bis-tetra-dentate manner and the copper atom has a fivefold NSBr coordination environment with a distorted shape. The reaction of ligand with copper(I) iodide also gave a binuclear complex, which is bridged by a CuI unit to form a two-dimensional coordination polymer, poly[[μ-2,5,8,11,14,17-hexa-thia-9.9-pyrazino-phane]tetra-μ-iodido-tetra-copper(I)], [CuI(CHNS)] , (). The binuclear unit possesses inversion symmetry with the pyrazine ring being located about a center of symmetry. The CuI unit is also located about an inversion center. The two independent copper(I) atoms are both fourfold coordinate. That coordinating to the ligand in a bis-tridentate manner has an NSI coordination environment and an irregular shape, while the second copper(I) atom, where coordinates in a bis-monodentate manner, has an SI coordination environment with an almost perfect tetra-hedral geometry. In the crystal of , the cations and Br anions are linked by a number of C-H⋯S and C-H⋯Br hydrogen bonds, forming a supra-molecular network. In the crystal of , the two-dimensional coordination polymers lie parallel to the plane and there are no significant inter-layer contacts present.
六硫代吡嗪并环配体2,5,8,11,14,17-六硫代-9.9-吡嗪并环()与二溴化铜反应生成了双核配合物二溴化[μ-2,5,8,11,14,17-六硫代-9.9-吡嗪并环]双[溴化铜(II)],[CuBr(CHNS)]Br,()。该配合物具有反演对称性,吡嗪环位于对称中心周围。配体以双四齿方式与铜(II)原子配位,铜原子具有扭曲形状的五重NSBr配位环境。配体与碘化亚铜的反应也生成了一个双核配合物,它由一个CuI单元桥连形成二维配位聚合物,聚[[μ-2,5,8,11,14,17-六硫代-9.9-吡嗪并环]四-μ-碘代-四铜(I)],[CuI(CHNS)] ,()。双核单元具有反演对称性,吡嗪环位于对称中心周围。CuI单元也位于一个反演中心周围。两个独立的铜(I)原子均为四重配位。以双三齿方式与配体配位的那个铜(I)原子具有NSI配位环境且形状不规则,而第二个以双单齿方式配位的铜(I)原子具有几乎完美四面体几何形状的SI配位环境。在的晶体中,阳离子和Br阴离子通过许多C-H⋯S和C-H⋯Br氢键相连,形成一个超分子网络。在的晶体中,二维配位聚合物与平面平行,且不存在显著的层间接触。