[(η(5)-C5H5)Fe(η(5)-C5H4CH=NC6H3-2-Me-)]2 | 186822-62-8

• 英文名称: [(η(5)-C5H5)Fe(η(5)-C5H4CH=NC6H3-2-Me-)]2
• 英文别名: [(η5-C5H5)Fe(η5-C5H4)CHN(C6H3-2-CH3)]2
• CAS: 186822-62-8
• 化学式: C₃₆H₃₂Fe₂N₂
• 分子量: 604.357
• InChiKey: DWRKWGWWLSYMIJ-UHFFFAOYSA-N

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：

  sodium tetrachloropalladate(II) 、 [(η(5)-C5H5)Fe(η(5)-C5H4CH=NC6H3-2-Me-)]2 在 sodium acetate 作用下， 以 甲醇 为溶剂， 以60%的产率得到[Pd2[(η(5)-C5H5)Fe(η(5)-C5H3CH=NC6H3-2-Me-)]2(μ-Cl)2]2
  参考文献：
  名称：

  Mono- and bis(cyclopalladation) of bis(ferrocenylimine)[(η5-C5H5)Fe(η5-C5H4)CHN (C6H3-2-CH3)−]2

  摘要：

  The reaction of the novel bis(ferrocenylimine) [(eta(5)-C5H5)Fe{(eta(5)-C5H4)-CH=N-(C6H3-2-CH3)-}](2) (1) with Na-2[PdCl4] and NaCH3COO . 3H(2)O in methanol in a 1:2:2 or a 1:1:1 molar ratio produces the polynuclear di-mu-chloro-bridged cyclopalladated compounds [Pd-2(eta(5)-C5H5)Fe[(eta(5)-C5H3)-CH=N-(C6H3-2-CH3)-]}(2)(mu-Cl)(2)](2) (2a) or [Pd{(eta(5)-C5H5)Fe[(eta(5)-C5H3)-CH=N-C6H3- 2-(CH3)-4-{(C6H3-2'-CH3)-N=CH-(eta(5)-C5H4)}]Fe(eta(5)-C5H5)}(mu-Cl)](2) (2b) respectively, which arise from the activation of two (for 2a) or one (for 2b) sigma(C-sp2,C-ferrocene-H) bonds. Addition of triphenylphosphine to benzene suspensions of compounds 2 produces the cleavage of the 'Pd(mu-Cl)(2)Pd' units and the formation of [Pd-2{eta(5)-C5H5)Fe[(eta(5)-C5H3)-CH=N-(C6H3-2-CH3)-]}Cl-2(2)(PPh(3))(2)] (3a), or [Pd{(eta(5)-C5H5)Fe[(eta(5)-C5H3)-CH=N-C6H3-2-(CH3)-4-{C6H3-(2'-CH3)-N=CH-(eta(5)-C5H4)}]Fe(eta(5)-C5H5)}Cl(PPh(3))] (3b) Proton and P-31 NMR studies on compounds 3 confirm the existence of two (in 3a) or one (in 3b) five-membered palladocycles fused with the ferrocenyl units, and a trans arrangement of the PPh(3) ligand and the imine nitrogen. Electrochemical studies of these compounds are also reported.

  DOI：

  10.1016/s0022-328x(96)06404-2
• 作为产物：
  描述：

  二茂铁甲醛 、 4,4'-二氨基-3,3'-二甲基联苯 在 aluminum oxide 作用下， 以 甲苯 为溶剂， 以89%的产率得到[(η(5)-C5H5)Fe(η(5)-C5H4CH=NC6H3-2-Me-)]2
  参考文献：
  名称：

  Studies on cyclomercuration of bisferrocenylimines

  摘要：

  Cyclomercuration of bisferrocenylimines [(eta(5)-C5H5)Fe{(eta(5)-C5H4)-CR=N-(C6H3-2-R')}](2), (R=H, CH3; R'=H, CH3, Cl) occurred predominantly in the ortho-position of the substituted ferrocenyl ring to yield double 2-mercurated ferrocenylimines, which arise from activation of two sigma(C-sp2,C-ferrocene-H) bonds. The composition and structure of the metallocycles were characterized by elemental analysis, IR, H-1 NMR and 2D C-13{H-1}-COSY spectra, which confirmed the existence of two five-membered mercuriocycles fused with the ferrocenyl moieties. (C) 2003 Elsevier Science Ltd. All rights reserved.

  DOI：

  10.1016/s0277-5387(03)00120-7