Vassilyeva Olga Yu, Buvaylo Elena A, Kokozay Vladimir N, Sobolev Alexandre N
Department of Chemistry, Taras Shevchenko National University of Kyiv, 64/13 Volodymyrska Street, Kyiv 01601, Ukraine.
School of Molecular Sciences, M310, the University of Western Australia, 35 Stirling Highway, Perth, 6009, W.A., Australia.
Acta Crystallogr E Crystallogr Commun. 2023 Jan 19;79(Pt 2):103-106. doi: 10.1107/S2056989023000324. eCollection 2023 Jan 1.
The hybrid salt bis-(2-methyl-imidazo[1,5-]pyridin-2-ium) hexa-chlorido-stannate(IV), (CHN)[SnCl], crystallizes in the monoclinic space group 2/ with the asymmetric unit containing an SnCl fragment (Sn site symmetry ) and one organic cation. The five- and six-membered rings in the cation are nearly coplanar; bond lengths in the pyridinium ring of the fused core are as expected; the C-N/C bond distances in the imidazolium entity fall in the range 1.337 (5)-1.401 (5) Å. The octa-hedral SnCl dianion is almost undistorted with the Sn-Cl distances varying from 2.4255 (9) to 2.4881 (8) Å and the Cl-Sn-Cl angles approaching 90°. In the crystal, π-stacked chains of cations and loosely packed SnCl dianions form separate sheets alternating parallel to (101). Most of the numerous C-H⋯Cl-Sn contacts between the organic and inorganic counterparts with the H⋯Cl distances above the van der Waals contact limit of 2.85 Å are considered a result of crystal packing.
混合盐双-(2-甲基-咪唑并[1,5 -]吡啶-2-鎓)六氯锡酸(IV),(CHN)[SnCl],结晶于单斜空间群2/,不对称单元包含一个SnCl片段(Sn位点对称性 )和一个有机阳离子。阳离子中的五元环和六元环几乎共面;稠合环吡啶鎓环中的键长符合预期;咪唑鎓实体中的C-N/C键距离在1.337 (5)-1.401 (5) Å范围内。八面体SnCl二阴离子几乎未变形,Sn-Cl距离在2.4255 (9)至2.4881 (8) Å之间变化,且Cl-Sn-Cl角接近90°。在晶体中,阳离子的π堆积链和松散堆积的SnCl二阴离子形成平行于(101)交替的单独片层。有机和无机部分之间众多C-H⋯Cl-Sn接触中,大多数H⋯Cl距离高于范德华接触极限2.85 Å,被认为是晶体堆积的结果。