Crystal structures and Hirshfeld surface analyses of (N-hexyl-N-methyl­dithio­carbamato-κ2S,S′)triphenyl­tin(IV) and [N-methyl-N-(2-phenyl­ethyl)­dithio­carbamato-κ2S,S′]tri­phenyl­tin(IV)

Mohamad R.; Awang N.; Kamaludin N.F.; Jotani M.M.; Tiekink E.R.T.

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Crystal structures and Hirshfeld surface analyses of (N-hexyl-N-methyldithiocarbamato-κ2S,S′)triphenyltin(IV) and [N-methyl-N-(2-phenylethyl)dithiocarbamato-κ2S,S′]triphenyltin(IV)

机译：（N-己基-N-甲基二硫代氨基甲酸酯-κ2S，S'）三苯基锡（IV）和[N-甲基-N-（2-苯基乙基）二硫代氨基甲酸酯-κ2S，S']三苯基锡（IV）的晶体结构和Hirshfeld表面分析

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The crystal and molecular structures of two triphenyltin dithiocarbamate compounds, viz. [Sn(C6H5)3(C8H16NS2)], (I), and [Sn(C6H5)3(C10H12NS2)], (II), are described. The dithiocarbamate ligand in each molecule coordinates in an asymmetric fashion resulting in heavily distorted tetrahedral C3S coordination geometries for the Sn atoms, with the distortions traced to the close approach of the non-coordinating thione-S atom. The molecular packing in both compounds features C—H⋯π(Sn-phenyl) interactions. In (I), the donors are Sn-phenyl-C—H groups leading to centrosymmetric aggregates, while in (II), the donors are both Sn-phenyl-C—H and methyl-C—H groups leading to supramolecular chains propagating along the b axis. The identified aggregates assemble into their respective crystals with no directional interactions between them. An analysis of the Hirshfeld surfaces show distinctive patterns, but an overwhelming predominance (99% in each case) of H⋯H, C⋯H/H⋯C and S⋯H/H⋯S contacts on the respective Hirshfeld surface.

机译：两种三苯基锡二硫代氨基甲酸酯化合物的晶体和分子结构。描述了[Sn（C6H5）3（C8H16NS2）]，（I）和[Sn（C6H5）3（C10H12NS2）]，（II）。每个分子中的二硫代氨基甲酸酯配体以不对称方式配位，导致Sn原子的四面体C3S配位几何严重扭曲，其畸变可追溯至非配位硫酮-S原子的接近途径。两种化合物中的分子堆积均具有CHHπ（Sn-苯基）相互作用。在（I）中，给体是导致中心对称聚集体的Sn-苯基-CH基团，而在（II）中，给体是导致超分子链传播的Sn-苯基-CH基团和甲基-CH基团沿b轴。鉴定出的聚集体组装成它们各自的晶体，它们之间没有方向相互作用。对Hirshfeld表面的分析显示出独特的图案，但是在各个Hirshfeld表面上的H⋯H，C⋯H / H⋯C和S⋯H / H⋯S接触占绝大多数（每种情况> 99％）。

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《Acta Crystallographica Section E: Crystallographic Communications》 |2018年第5期|共8页
作者
Mohamad R.; Awang N.; Kamaludin N.F.; Jotani M.M.; Tiekink E.R.T.;
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中图分类晶体学;
关键词
CRYSTAL STRUCTUREORGANOTINDITHIOCARBAMATEHIRSHFELD SURFACE ANALYSIS;

机译：晶体结构或有机基氨基甲烷氨基甲酸乙酯表面分析;

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1. Di-n-butylbis[N-(2-methoxyethyl)-N-methyldithiocarbamato-κ2S,S′]tin(IV): crystal structure and Hirshfeld surface analysis [J] . Mohamad R., Awang N., Kamaludin N.F., Acta Crystallographica Section E: Crystallographic Communications . 2017,第2期

机译：二正丁基双[N-（2-甲氧基乙基）-N-甲基二硫代氨基甲酸酯-κ2S，S']锡（IV）：晶体结构和Hirshfeld表面分析
2. Di-n-butylbis(N-cyclohexyl-N-ethyldithiocarbamato-κ2S,S′)tin(IV) [J] . Awang N., Baba I., Ng S.W., Acta Crystallographica Section E: Crystallographic Communications . 2010,第8期

机译：二正丁基双（N-环己基-N-乙基二硫代氨基甲酸酯-κ2S，S'）锡（IV）
3. [N,N-Bis(2-hydroxyethyl)dithiocarbamato-κ2S,S′]bis(triphenylphosphane-κP)copper(I) chloroform monosolvate: crystal structure, Hirshfeld surface analysis and solution NMR measurements [J] . Tan S.L., Yeo C.I., Heard P.J., Acta Crystallographica Section E: Crystallographic Communications . 2016,第12期

机译：[N，N-双（2-羟乙基）二硫代氨基甲酸酯-κ2S，S']双（三苯基膦-κP）铜（I）氯仿单溶剂化物：晶体结构，Hirshfeld表面分析和溶液NMR测量
4. Crystal structures and Hirshfeld surface analyses of (N-hexyl-N-methyldithiocarbamato-κ2SS′)triphenyltin(IV) and N-methyl-N-(2-phenylethyl)dithiocarbamato-κ2SS′triphenyltin(IV) [O] . Rapidah Mohamad, Normah Awang, Nurul Farahana Kamaludin, 2018

机译：（N-己基-N-甲基二硫基氨基甲酸酯-κ2的晶体结构和Hirshfeld表面分析SS）三苯基锡（IV）和N-甲基-N-（2-苯基乙基）二硫氨基甲酸酯-κ2SS三苯基锡（IV）
5. Distinct coordination geometries in bisN,N-bis(2-methoxyethyl)dithiocarbamato-κ2S,S′diphenyltin(IV) and bisN-(2-methoxyethyl)-N-methyldithiocarbamato-κ2S,S′diphenyltin(IV): crystal structures and Hirshfeld surface analysis [O] . Rapidah Mohamad, Normah Awang, Jotani Mukesh M., 2016

机译：双N，N-双（2-甲氧基乙基）二硫代氨基甲酸-κ2S，S'二苯基锡（IV）和双N-（2-甲氧基乙基）-N-甲基二硫代氨基甲酸-κ2S，S'二苯基锡（IV）的不同配位几何）：晶体结构和Hirshfeld表面分析

Crystal structures and Hirshfeld surface analyses of (N-hexyl-N-methyl­dithio­carbamato-κ2S,S′)triphenyl­tin(IV) and [N-methyl-N-(2-phenyl­ethyl)­dithio­carbamato-κ2S,S′]tri­phenyl­tin(IV)

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Crystal structures and Hirshfeld surface analyses of (N-hexyl-N-methyldithiocarbamato-κ2S,S′)triphenyltin(IV) and [N-methyl-N-(2-phenylethyl)dithiocarbamato-κ2S,S′]triphenyltin(IV)