Molecular complex of [60]fullerene with 2-(4-thione-1,3-dithiolan-5-yliden)-4,5-dimethyl-1,3-diselenol [C-60 center dot 2(DTDS)]: Synthesis, crystal structure and properties

Spitsina NG.; Lobach AA.; Golubev EV.; Kaplunov MG. Dyachenko OA.; Konovalikhin SV.

首页> 外文期刊>Fullerene science and technology >Molecular complex of [60]fullerene with 2-(4-thione-1,3-dithiolan-5-yliden)-4,5-dimethyl-1,3-diselenol [C-60 center dot 2(DTDS)]: Synthesis, crystal structure and properties

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Molecular complex of [60]fullerene with 2-(4-thione-1,3-dithiolan-5-yliden)-4,5-dimethyl-1,3-diselenol [C-60 center dot 2(DTDS)]: Synthesis, crystal structure and properties

机译：[60]富勒烯与2-（4-硫酮-1,3-二硫杂环戊-5-基）-4,5-二甲基-1,3-二硒酚[C-60中心点2（DTDS）]的分子复合物：合成，晶体结构与性能

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New molecular complexes of [60]fullerene with 2-(4-thione-1,3-dithiolan-5-yliden)-4,5dimethyl-1,3-diselenol [C-60.2(DTDS)] have been synthesized, crystal structure, IR spectral and electrochemical properties have been studied. Partial charge transfer has been found. An unusual shortening of the endocyclic S-C(sp(2)) bond in the DTDS molecule has been found to be stipulated by conformational vibrations of the >CH2 group. A comparative analysis of the X-ray data for the [C-60. (DTDS)] crystals and the quantum chemical calculations (SCF MO, 6-31G* basis) for the DTDS molecules and its radical ions showed charge transfer not to be the cause for the shortening of the exocyclic C=S bonds. [References: 20]

机译：合成了[60]富勒烯与2-（4-硫酮-1,3-二硫戊基-5-基）-4,5二甲基-1,3-二硒酚[C-60.2（DTDS）]的新分子配合物，晶体结构，已经研究了IR光谱和电化学性质。已找到部分费用转移。 DTDS分子中的内环S-C（sp（2））键的异常缩短已被发现是由> CH2基团的构象振动引起的。 [C-60]的X射线数据的比较分析。（DTDS）]晶体和DTDS分子及其自由基离子的量子化学计算（基于SCF MO，6-31G *）显示，电荷转移并不是缩短环外C = S键的原因。 [参考：20]

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《Fullerene science and technology》 |2000年第6期|共16页
作者
Spitsina NG.; Lobach AA.; Golubev EV.; Kaplunov MG. Dyachenko OA.; Konovalikhin SV.;
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正文语种 eng
中图分类物理化学（理论化学）、化学物理学;
关键词
Fullerenes c-60; X-ray; C-70;

机译：富勒烯c-60;X射线;C-70;

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1. Molecular complex of [60]fullerene with 2-(4-thione-1,3-dithiolan-5-yliden)-4,5-dimethyl-1,3-diselenol [C-60 center dot 2(DTDS)]: Synthesis, crystal structure and properties [J] . Spitsina NG., Lobach AA., Golubev EV., Fullerene science and technology . 2000,第6期

机译：[60]富勒烯与2-（4-硫酮-1,3-二硫杂环戊-5-基）-4,5-二甲基-1,3-二硒酚[C-60中心点2（DTDS）]的分子复合物：合成，晶体结构与性能
2. New complexes of fullerenes C-60 and C-70 with organic donor DBTTF: synthesis, some properties and crystal structure of DBTTF center dot C-60 center dot C6H6 (DBTTF=dibenzotetrathiafulvalene) [J] . Konarev DV., Slovokhotov YL., Shulga YM., Synthetic Metals . 1998,第1期

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3. Supramolecular approach to the synthesis of [60]fullerene-metal dithiocarbamate complexes, {(M-II(R(2)dtc)(2))(x)center dot L}center dot C-60 (M = Zn, Cd, Hg, Fe, and Mn; x=1 and 2). The study of magnetic properties and photoconductivity [J] . Konarev DV, Khasanov SS, Kovalevsky AY, Crystal growth & design . 2008,第4期

机译：超分子方法合成[60]富勒烯-金属二硫代氨基甲酸酯配合物，{（M-II（R（2）dtc）（2））（x）中心点L}中心点C-60（M = Zn，Cd， Hg，Fe和Mn; x = 1和2）。磁性和光电导性的研究
4. RUTHENIUM(II) TRIS-BIPYRIDINE COMPLEXES WITH A 60FULLERENE LIGAND: SYNTHESIS AND PROPERTIES [C] . Michele Maggini, Enzo Menna, Giorgia Possamai, International Symposium on Fullerenes, Nanotubes, and Carbon Nanoclusters, Mar, 25-29, 2001, Washington, D.C. . 2001

机译：60富勒烯配体的钌（II）三联吡啶络合物的合成与性能
5. Fluoroalkyl and Fluoroaryl Fullerenes, Polycyclic Aromatic Hydrocarbons, and Copper(I) Complexes: Synthesis, Structure, Electrochemical, Photophysical, and Device Properties [D] . Reeves, Brian J. 2020

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Molecular complex of [60]fullerene with 2-(4-thione-1,3-dithiolan-5-yliden)-4,5-dimethyl-1,3-diselenol [C-60 center dot 2(DTDS)]: Synthesis, crystal structure and properties

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