Tanaka Takeshi, Kashiwagi Yukiyasu, Nakagawa Masami
Osaka Research Institute of Industrial Science and Technology, 2-7-1 Ayumino, Izumi, Osaka 594-1157, Japan.
Osaka Research Institute of Industrial Science and Technology, 1-6-50 Morinomiya, Joto-ku, Osaka 536-8553, Japan.
Acta Crystallogr E Crystallogr Commun. 2020 Oct 6;76(Pt 11):1712-1715. doi: 10.1107/S2056989020013146. eCollection 2020 Nov 1.
The title crystalline compound, [Cu(NCS)(CHN)], was obtained from the reaction of copper(I) thio-cyanate (CuSCN) with (-prop-2-en-1-yl)piperidine-1-carbo-thio-amide as a chelating and bridging thio-urea ligand in chloro-benzene. The CuS core of the dimeric mol-ecule is situated on a crystallographic inversion centre. The copper atom is coordinated by a thio-cyanate nitro-gen atom, each sulfur atom of the two thio-urea ligands, and the C=C double bond of the ligand in a distorted tetra-hedral geometry. The dimers are linked by N-H⋯S hydrogen bonds, forming a network extending in two dimensions parallel to (100).
标题晶体化合物[Cu(NCS)(CHN)]是由硫氰酸亚铜（CuSCN）与（-2-丙烯-1-基）哌啶-1-碳硫酰胺作为螯合和桥连硫脲配体在氯苯中反应得到的。二聚体分子的CuS核心位于一个晶体学反演中心上。铜原子由一个硫氰酸根氮原子、两个硫脲配体的每个硫原子以及配体的C=C双键以扭曲的四面体几何构型配位。二聚体通过N-H⋯S氢键相连，形成一个平行于（100）在二维方向上延伸的网络。
