Wellm Carsten, Näther Christian
Institut für Anorganische Chemie, Universität Kiel, Max-Eyth. Str. 2, 241128 Kiel.
Acta Crystallogr E Crystallogr Commun. 2018 Nov 30;74(Pt 12):1899-1902. doi: 10.1107/S2056989018016432. eCollection 2018 Dec 1.
The asymmetric unit of the title compound, [Mn(NCS)(CHNO)], consists of one Mn cation located on a centre of inversion, one thio-cyanate anion and two 4-benzoyl-pyridine co-ligands. The Mn cation is octa-hedrally coordinated by two terminally N-bonded anionic ligands and four N-bonded 4-benzoyl-pyridine co-ligands within a slightly distorted octa-hedron. Individual complexes are linked by inter-molecular C-H⋯O hydrogen-bonding inter-actions into chains running along the axis direction. Simultaneous thermogravimetry and differential scanning calorimetry measurements reveal a decomposition in two separate steps, in each of which two co-ligands are removed. The compound obtained after the first step has the composition [Mn(NCS)(CHNO)] and is of unknown structure, before in the second step decomposition into [Mn(NCS)] is observed. Magnetic susceptibility measurements show the Mn cations to be in the high-spin state, and that weak anti-ferromagnetic inter-actions between the complexes are present.
标题化合物[Mn(NCS)(C₅H₅NO)]的不对称单元由一个位于反演中心的Mn阳离子、一个硫氰酸根阴离子和两个4-苯甲酰基吡啶共配体组成。Mn阳离子在一个轻微扭曲的八面体中由两个末端N键合的阴离子配体和四个N键合的4-苯甲酰基吡啶共配体八面体配位。各个配合物通过分子间C-H⋯O氢键相互作用连接成沿轴方向延伸的链。同时进行的热重分析和差示扫描量热法测量显示分解分两个独立步骤进行,在每个步骤中两个共配体被除去。第一步后得到的化合物组成为[Mn(NCS)(C₅H₅NO)]且结构未知,之后在第二步中观察到分解为[Mn(NCS)]。磁化率测量表明Mn阳离子处于高自旋态,并且配合物之间存在弱反铁磁相互作用。