[(η5-cyclopentadienyl)Co(S2C2(methyl)(H))] | 293329-06-3

• 分子结构分类: 有机化合物 - 碳氢化合物 - 芳香烃
• 英文名称: [(η5-cyclopentadienyl)Co(S2C2(methyl)(H))]
• 英文别名: [CpCo(S2C2(Me)(H))]；cobalt(3+);cyclopenta-1,3-diene;(Z)-prop-1-ene-1,2-dithiolate
• CAS: 293329-06-3
• 化学式: C₈H₉CoS₂
• 分子量: 228.285
• InChiKey: SEHRHMSXSMSAPX-PMOSZIESSA-L

计算性质

• 辛醇/水分配系数(LogP)：
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• 重原子数：
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• 可旋转键数：
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• 环数：
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• sp3杂化的碳原子比例：
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• 拓扑面积：
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• 氢给体数：
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• 氢受体数：
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反应信息

• 作为反应物：
  描述：

  [(η5-cyclopentadienyl)Co(S2C2(methyl)(H))] 在 HCl 作用下， 以 四氢呋喃 为溶剂， 以52%的产率得到μ-(1,4-dimethyl-1,3-butadiene-1,2,3,4-tetrathiolato)-bis[(η(5)-cyclopentadienyl)cobalt(III)]
  参考文献：
  名称：

  通过CpCo（二硫代烯）配合物与N-卤代琥珀酰亚胺的反应，对芳族金属环的罕见直接酰亚胺化

  摘要：

  芳族化合物[CpCo（S 2 C 2（R）（H））]（R = Ph，Me，9-菲基，H）络合物与N-卤代琥珀酰亚胺（NXS; X = Cl，Br，I）在四氯化碳中反应在室温下在二硫代烯环上进行N-琥珀酰亚胺取代反应，但未得到卤代二硫代烯配合物。酰亚胺化产物[CpCo（S 2 C 2（R）（N -sccinimide）））的产率高达64％，其中X ＝ 1，R  ＝ 9-菲基。[CpCo（S 2 C 2（Ph）（H））]与N-溴邻苯二甲酰亚胺（NBP）的反应也得到了酰亚胺化产物[CpCo（S 2 C 2（Ph）（N-邻苯二甲酰亚胺））。这是NXS对芳族金属环氧化物罕见的直接酰亚胺化反应。[CpCo（S 2 C 2 H 2）]（R = H）与NIS的反应得到双酰亚胺化产物。该反应中的一个副产物是二硫代苯二硫代均质偶合产物[CpCo（S 2 C 2（R））] 2（R = Ph，Me，9-菲基）。尝

  DOI：

  10.1016/j.jorganchem.2010.12.011

文献信息

• Synthesis and Chemical Properties of Metalladithiolene and Metalladithiazole Rings. Unique Reactions Due to Coexistence of Aromaticity and Unsaturation
  作者：Akira Sugimori、Takeo Akiyama、Masatsugu Kajitani、Toru Sugiyama

  DOI：10.1246/bcsj.72.879

  日期：1999.5

  alkyne, and elemental sulfur and by the reaction between [CpM(CO)n] and sulfur-containing heterocyclic compounds are described. Several ionic and radical substitution reactions are presented. The substitutions by carbon-centered and sulfur-centered radicals occur in the metalladithiolene rings. Benzoyloxy-substitution by dibenzoyl peroxide (BPO) and succinimido-substitution by N-halosuccinimides (NXS)

  综述了我们研究组发现的金属二硫烯环（特别是在 [CpM(S2C2R1R2)] 型配合物中）的合成和独特的化学性质。描述了通过 [CpM(CO)n]、炔烃和元素硫之间的一锅反应以及通过 [CpM(CO)n] 和含硫杂环化合物之间的反应构建金属二硫烯环。介绍了几种离子和自由基取代反应。碳中心和硫中心基团的取代发生在金属二硫烯环中。过氧化二苯甲酰 (BPO) 的苯甲酰氧基取代和 N-卤代琥珀酰亚胺 (NXS) 的琥珀酰亚胺基取代是通过 BPO 和 NXS 在与硫原子上的孤对电子相互作用中的异解诱导的离子机制进行的。这些取代是由于金属二硫烯环的芳香特性。还描述了由于金属二硫烯环的不饱和特性引起的独特加成反应。重氮化合物和叠氮化物反应...
• Sulfur-centered and nitrogen-centered radical substitution reactions of aromatic CpCo(dithiolene) complex with 2,2′-Dibenzothiazolyl disulfide
  作者：Mitsushiro Nomura、Hiroki Oguro、Kazuaki Maeshima、Suguru Iida、Satoshi Horikoshi、Toru Sugiyama、Akira Sugimori、Masatsugu Kajitani

  DOI：10.1016/j.jorganchem.2010.03.032

  日期：2010.6

  Aromatic [CpCo(S2C2(R)(H))] complexes(R = Me (1) and Ph (5)) reacted with 2,2'-dibenzothiazolyl disulfide (2, R'SSR' (R' = 2-benzothiazolyl)) as a sulfur-centered radical source to form some radical substitution products. 2-Benzothiazolylthiyl radical (R'S-center dot) was substituted on the dithiolene ring or on the Me group of 1 to give[CpCo(S2C2(Me)(SR'))] (3) or [CpCo(S2C2(CH2SR')(H))] (4), respectively. The reaction of 5 with 2 gave two different substitution products on the dithiolene ring but they were structural isomers. One was the substitution product [CpCo(S2C2(Ph)(SR'))] (6) by the R'S-center dot radical substitution (S-substituted product), and the other was N-substituted product (7). 7 was formed by a nitrogen-centered radical that is a resonant species of the 2-benzothiazolylthiyl radical. Conventional heating, photochemical and microwave-enhanced reactions were performed. The molecular structures of 3, 4 and 7 were determined by X-ray diffraction studies. (C) 2010 Elsevier B.V. All rights reserved.