1,5-diselena[5]ferrocenophane | 143053-64-9

• 英文名称: 1,5-diselena[5]ferrocenophane
• CAS: 143053-64-9
• 化学式: C₁₃H₁₄FeSe₂
• 分子量: 384.021
• InChiKey: VNCCGWWIKABZTI-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  None
• 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：
  None
• 氢给体数：
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• 氢受体数：
  None

反应信息

• 作为反应物：
  描述：

  (bicyclo[2.2.1]hepta-2,5-diene)tetracarbonylmolybdenum(0) 、 1,5-diselena[5]ferrocenophane 以 甲苯 为溶剂， 以55%的产率得到[(1,5-diselena[5]ferrocenophane)Mo(CO)4]
  参考文献：
  名称：

  Group 6 metal carbonyl complexes of 1,5-diselena[5]ferrocenophane: Synthesis, characterization, crystallographic and electrochemical study

  摘要：

  The group 6 metal complexes of 1,5-diselena[5]ferrocenophane (L) have been prepared and characterized. The structures of [M(CO)(4)L] (M = Cr, Mo) show that L adopts the unusual meso-2 conformation. E(1/2) of the 1,1'-ferrocenylene group in three complexes is much more positive than that of the "free" ligand L due to the electron donation from L to the M(CO)(4)L fragment. (C) 2010 Elsevier B.V. All rights reserved.

  DOI：

  10.1016/j.ica.2010.01.031
• 作为产物：
  描述：

  1,2,3-triselena[3]ferrocenophane 、 1,3-二溴丙烷 在 NaBH₄ 作用下， 以 乙醇 为溶剂， 以80%的产率得到1,5-diselena[5]ferrocenophane
  参考文献：
  名称：

  Complexation and electrochemical study of 1,5-diselena[5]ferrocenophane: X-ray crystal structures of 1,5-diselena[5]ferrocenophane, and silver, mercury complexes

  摘要：

  The silver(I) and mercury(II) complexes of 1,5-diselena[5]ferrocenophane (L) have been synthesized. The X-ray crystal structures of L. [AgL2]PF6 and [Hgl(2)L] are reported. The small cavity of the macrocyclic ligand means that the ring must undergo a conformational change to allow coordination, and there is no significant through-space interaction M center dot center dot center dot Fe in any of the complexes. Electrochemical studies showed that no electronic communication between ferrocenylene groups was observed in the silver complex where the through-bond Fe center dot center dot center dot Fe distances are in the range 13.10 (3)-13.27(3) angstrom. (c) 2009 Elsevier B.V. All rights reserved.

  DOI：

  10.1016/j.inoche.2009.03.008

文献信息

• Microenvironment modulation of cuprous cluster enables inert aryl chlorides activation in single-molecule metallaphotoredox amination
  作者：Guo-Jin Zha、Wei Ji、Zheng-Hang Qi、Wen-Jie Qiu、Ai-Min Li、Dun-Ru Zhu、Su Jing

  DOI：10.1016/j.jcat.2021.12.007

  日期：2022.1

  microenvironment with ferrocenyl and phenyl groups. The cuprous cluster [Cu2I2(L1)] (C1) was proved to be an effective white light-driven SMP, successfully catalyzing the amination of aryl halides with carbazole. This method showed a diverse substrate scopes of aryl halides with electronical and structural variety, affording the highest yield of 63% for 4-chlorobenzonitrile. X-ray crystallographic, in situ electron

  芳基卤的胺化是有机合成中的重要工具，惰性芳基氯的活化特别困难。我们在此报告了对亚铜簇作为单分子金属光催化剂 ( SMP ) 在 CN偶联反应中直接活化苯氯的芳香微环境调节的首次研究。硒醚L1旨在提供具有二茂铁基和苯基的芳香微环境。亚铜簇 [Cu 2 I 2 ( L1 ) ] ( C1 ) 被证明是一种有效的白光驱动SMP，成功地催化芳基卤化物与咔唑的胺化。该方法显示了具有电子和结构多样性的芳基卤化物的多种底物范围，4-氯苄腈的产率最高，为 63%。X 射线晶体学、原位电子顺磁共振 (EPR) 光谱研究和密度泛函理论 (DFT) 计算表明，C1中的芳香微环境通过SMP和芳基卤化物之间的 π-π 相互作用促进了有效的分子间电子转移。有趣的是，胺化的机制取决于所应用的基材。单电子转移 ( SET ) 和 Cu 2+ 的形成当应用 Ph-I/Ph-Br 时发现了中间体，而当使用 Ph-Cl 底物时，发现了具有