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首页> 外文期刊>Polyhedron: The International Journal for Inorganic and Organometallic Chemistry >Modulation of intermolecular exchange interaction in organic radical based compounds: Magneto-structural analysis of phenol and imidazolium substituted oxoverdazyl radicals
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Modulation of intermolecular exchange interaction in organic radical based compounds: Magneto-structural analysis of phenol and imidazolium substituted oxoverdazyl radicals

机译:基于有机基团的化合物之间的分子间交换相互作用的调节:苯酚和咪唑鎓取代的过氧二氮杂基的磁性结构分析

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摘要

The synthesis of two oxoverdazyls based compounds, the 1,5-dimethyl-3-(2'-hydroxyphenyl)-6-oxoverdazyl 1 and the perchlorate salt of 1,5-dimethyl-3-(2'-imidazolium)-6-oxoverdazyl 2 are reported. The structural analysis of I reveals that radicals are closely packed in regular columns by way of pi-stacking. In contrast, the packing in 2 is definitely influenced by the protonation state of the radical substituent and shows strong lateral staggering of the organic radicals. The organisation in the solid state strongly influences the intermolecular exchange interaction between pi-stacked radicals which goes from J = -113 cm(-1) (H = -J Sigma SiSi+1) in 1 to J = -1.0 cm(-1) and J' = -0.67 cm(-1) in 2.
机译:两种基于过氧过氧烷基的化合物1,5-二甲基-3-(2'-羟基苯基)-6-过氧过氧烷基1和1,5-二甲基-3-(2'-咪唑鎓)-6-的高氯酸盐的合成报道了oxoverdazyl 2。 I的结构分析表明,自由基通过pi堆积紧密地排布在规则的列中。相反,2中的堆积肯定受自由基取代基的质子化状态影响,并且显示出有机自由基的强烈侧向错位。固态组织极大地影响pi堆积自由基之间的分子间交换相互作用,其相互作用从J = -113 cm(-1)(H = -J Sigma SiSi + 1)在1到J = -1.0 cm(-1) ),J'= -0.67 cm(-1)in 2。

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