(η5-cyclopentadienyl)Fe(carbonyl)2(CC(ferrocenyl)) | 157144-29-1

• 英文名称: (η5-cyclopentadienyl)Fe(carbonyl)2(CC(ferrocenyl))
• CAS: 157144-29-1
• 化学式: C₁₉H₁₄Fe₂O₂
• 分子量: 386.013
• InChiKey: AYVPBSUMAQEOQJ-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  None
• 重原子数：
  None
• 可旋转键数：
  None
• 环数：
  None
• sp3杂化的碳原子比例：
  None
• 拓扑面积：
  None
• 氢给体数：
  None
• 氢受体数：
  None

反应信息

• 作为反应物：
  描述：

  (η5-cyclopentadienyl)Fe(carbonyl)2(CC(ferrocenyl)) 在 dichlorodicyanobenzoquinone 作用下， 以 二氯甲烷 、 苯 为溶剂， 以94%的产率得到
  参考文献：
  名称：

  Oxidized FeII ferrocenylacetylide complexes. A novel type of mixed-valence complex

  摘要：

  Reaction of lithium ferrocenylacetylide with (eta-C5H5)LL'FeI (L = L' = CO, L = L' = P(OMe)3, and L = CO, L' = PPh3) gave the corresponding Fe(II) ferrocenylacetylide complexes, (eta-C5H5)LL'FeCCFc, in moderate yields. (Eta-C5Me5)(CO)2FeCCFc was similarly prepared. In their cyclic voltammograms, all the complexes gave two irreversible waves in acetonitrile. The complexes, when oxidized with various oxidants, showed a broad absorption in the near-infrared region and low frequency-shift of the acetylide group in the IR spectrum. The spectral data suggest that the oxidized complexes are a novel Class II type of mixed-valence complex.

  DOI：

  10.1016/0022-328x(94)88123-5
• 作为产物：
  描述：

  dicarbonylcyclopentadienyliodoiron(II) 、 二茂铁乙炔 在 MeLi 作用下， 以 四氢呋喃 、 乙醚 为溶剂， 以84%的产率得到(η5-cyclopentadienyl)Fe(carbonyl)2(CC(ferrocenyl))
  参考文献：
  名称：

  Oxidized FeII ferrocenylacetylide complexes. A novel type of mixed-valence complex

  摘要：

  Reaction of lithium ferrocenylacetylide with (eta-C5H5)LL'FeI (L = L' = CO, L = L' = P(OMe)3, and L = CO, L' = PPh3) gave the corresponding Fe(II) ferrocenylacetylide complexes, (eta-C5H5)LL'FeCCFc, in moderate yields. (Eta-C5Me5)(CO)2FeCCFc was similarly prepared. In their cyclic voltammograms, all the complexes gave two irreversible waves in acetonitrile. The complexes, when oxidized with various oxidants, showed a broad absorption in the near-infrared region and low frequency-shift of the acetylide group in the IR spectrum. The spectral data suggest that the oxidized complexes are a novel Class II type of mixed-valence complex.

  DOI：

  10.1016/0022-328x(94)88123-5

文献信息

• Synthesis and Oxidation of Iron(II) Ferrocenylacetylide Diphosphine Complexes. A Novel Type of Mixed-Valence Complex
  作者：Masaru Sato、Yukiko Hayashi、Shigekazu Kumakura、Natsuko Shimizu、Motomi Katada、Satoshi Kawata

  DOI：10.1021/om950525d

  日期：1996.1.23

  Some Fe(II) ferrocenylacetylide complexes, [(Cp or Cp*)(PP)FeC⋮CFc], were prepared by the photolysis of the corresponding carbonyl complexes [(Cp or Cp*)(CO)2FeC⋮CFc] in the presence of diphosphines (PP = dppe, dppm, dmpe). The cyclic voltammograms showed two quasi-reversible waves at −0.47 to −0.84 and +0.08 to +0.12 V. The one-electron-oxidized species were isolated as relatively stable solids from

  通过将相应的羰基配合物[（Cp或Cp *）（CO）2 FeC⋮CFc ）进行光解制备了一些Fe（II）二茂铁基乙炔配合物[[（Cp或Cp *）（PP）FeC⋮CFc]。存在二膦（PP = dppe，dppm，dmpe）。循环伏安图显示了在-0.47至-0.84和+0.08至+0.12 V处的两个准可逆波。从中性Fe（II）配合物与DDQ或FcHPF 6。氧化络合物在1295年至1595年处表现出intervalence转印带，和从位置计算的相互作用参数（α 2 =（0.98-2.44）×10 -2）。这表明这些是高度电子离域的混合价络合物。红外光谱（νCC = 1956−1976 cm -1），ESR光谱（一个宽信号的出现）和Mössbauer光谱（QS = 2.00−2.26 mm s -1）支持上述建议。通过单晶X射线衍射确定[Cp（dppe）FeC⋮CFC]的结构。
• Chalcogen–acetylide interaction and unusual reactivity of coordinated acetylide with water: synthesis and characterisation of [(η5-C5R5)Fe3(CO)6(μ3-E)(μ3-ECCH2RI)] (R=H, Me; RI=Ph, Fc; E=S, Se) and [(η5-C5R5)MoFe2(CO)6(μ3-S)(μ-SCCH2Ph)] (R=H, Me)
  作者：Pradeep Mathur、Chimalakonda Srinivasu、Shaikh M Mobin

  DOI：10.1016/s0022-328x(02)02123-x

  日期：2003.1

  benzene solution containing [Fe3(CO)9(μ3-E)2] (E=S, Se), [(η5-C5R5)Fe(CO)2(CCRI)] (R=H, Me; RI=Ph, Fc), H2O and Et3N results in formation of new metal clusters [(η5-C5R5)Fe3(CO)6(μ3-E)(μ3-ECCH2RI)] (R=H, RI=Ph, E=S 1 or Se 2; R=Me, RI=Ph, E=S 3 or Se 4; R=H, RI=Fc, E=S 5; R=Me, RI=Fc, E=S 6 or Se 7). Reaction of [Fe3(CO)9(μ3-S)2]with [(η5-C5R5)Mo(CO)3(CCPh)] (R=H, Me), under same conditions, produces

  含有苯溶液的光解的[Fe 3（CO）9（μ 3 -E）2 ]（E = S，Se）的，[（η 5 -C 5 - [R 5）的Fe（CO）2（CCR我） ]（R = H中，Me; R我=苯基，FC），H 2 O和的Et 3个N个结果中形成新的金属簇[（η 5 -C 5 - [R 5）的Fe 3（CO）6（μ 3 - E）（μ 3 -ECCH 2 - [R我）]（R = H，R我=苯基，E = S 1或Se2 ; R = Me，R I = Ph，E = S 3或Se 4；R = H，R I = Fc，E = S 5；R = Me，R I = Fc，E = S 6或Se 7）。的反应的[Fe 3（CO）9（μ 3 -S）2 ]与[（η 5 -C 5 - [R 5）的Mo（CO）3（CCPh）]（R = H，Me）时，在相同的的条件下，产生的混合的金属簇[（η 5 -C 5 - [R 5）钼铁2（CO）6（μ