[(η-toluene)(η-H5C3)Mo(μ-Cl)2Mo(η-C3H5)(η-toluene)] | 35625-66-2

• 英文名称: [(η-toluene)(η-H5C3)Mo(μ-Cl)2Mo(η-C3H5)(η-toluene)]
• 英文别名: di-μ-chloro-bis((η-allyl)(η-toluene)molybdenum)；[Mo(η3-C3H5)(μ-Cl)(η6-C6H5CH3)]2
• CAS: 35625-66-2
• 化学式: C₂₀H₂₆Cl₂Mo₂
• 分子量: 529.212
• InChiKey: RGUFFWFUWCDCDA-UHFFFAOYSA-L

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：

  [(η-toluene)(η-H5C3)Mo(μ-Cl)2Mo(η-C3H5)(η-toluene)] 、 2-diphenylphosphino-N,N-diphenylacetamide 在 ammonium chloride 作用下， 以 乙醇 为溶剂， 以63%的产率得到[Mo(η3-C3H5)(Cl)(η6-C6H5CH3)Ph2PCH2C(O)NPh2]
  参考文献：
  名称：

  Jones, Neale G.; Green, Malcolm L.H.; Vei, Ino C., Journal of the Chemical Society. Dalton Transactions (2001), 2002, # 12, p. 2491 - 2500

  摘要：

  DOI：

文献信息

• Synthesis of molybdenum arene complexes containing amide-derived heterodifunctional P,O ligands
  作者：Neale G. Jones、Malcolm L. H. Green、Ino Vei、Andrew Cowley、Xavier Morise、Pierre Braunstein

  DOI：10.1039/b105957m

  日期：2002.3.26

  The reactions of the amide-derived ligands Ph2PN(R)C(O)CH3 (R = H, CH3) with the molybdenum arene complexes [Mo(η3-C3H5)(μ-Cl)(η6-C6H5R)]2 (R = H, CH3) have been investigated. A series of complexes in which the functional ligand displays η1-phosphine, η2-acetamidophosphine and η2-phosphinoiminolate coordination have been synthesised and characterised. The crystal structures of the cationic compounds [Mo(η3-C3H5)(η6-C6H6)Ph2PN(R)C(O)CH3-κ2P,O}][PF6] (R = H, CH3) have been determined. The first example of a structurally characterised phosphinoiminolate complex [Mo(η3-C3H5)(η6-C6H6)Ph2PNC(O)CH3-κ2P,O}] is also reported.

  研究了酰胺衍生配体 Ph2PN(R)C(O)CH3（R = H、 ）与钼炔配合物 [Mo(η3-C3H5)(μ-Cl)(η6-C6H5R)]2（R = H、 ）的反应。合成并表征了一系列配合物，其中的功能配体显示出 η1-膦、η2-乙酰胺基膦和 η2-膦亚胺酸配位。阳离子化合物 [Mo(η3- )(η6-C6H6)Ph2PN(R)C(O) -κ2P,O}][PF6]（R = H、 ）的晶体结构已经确定。此外，还首次报道了具有结构特征的膦亚胺酸络合物 [Mo(η3- )(η6- )Ph2PNC(O) -κ2P,O}]。
• A comparison of the electronic structure of some Group 6A dimetal tetracarboxylates using photoelectron spectroscopy
  作者：Anthony W. Coleman、Jennifer C. Green、Andrew J. Hayes、Elaine A. Seddon、D. Robert Lloyd、Yoshio Niwa

  DOI：10.1039/dt9790001057

  日期：——

  He(I) and He(II) photoelectron spectra are presented for [Cr2(O2CR)4](R = Me or Et), [CrMo(O2CMe)4], and [Mo2(O2CR)4](R = H, Me, CMe3, or CF3). Ionization energies and intensities are discussed in relation to ab initio and SCF–Xα-SW calculations. A σ2π4δ2 configuration for the metal electrons gives the most plausible explanation for all spectra, but the 2Σ, 2Π and 2Δ ion states lie much closer in energy

  给出了[Cr 2（O 2 CR）4 ]（R = Me或Et），[CrMo（O 2 CMe）4 ]和[Mo 2（O 2 CR ）的He（I）和He（II）光电子能谱。）4 ]（R = H，Me，CMe 3或CF 3）。讨论了从头算和SCF-Xα-SW计算的电离能和强度。甲σ 2 π 4 δ 2配置金属中的电子给出了所有光谱中的最合理的解释，但2 Σ，2 Π和2相对于钼类似物，四羧酸重铬酸铬的Δ离子态更接近能量。
• Arene–molybdenum chemistry: reactions of di-µ-chloro-bis[(η-allyl)-(η-arene)molybdenum] with cyclic olefins
  作者：Malcolm L. H. Green、John Knight

  DOI：10.1039/dt9760000213

  日期：——

  compounds [Mo(η-C3H5)(η-arene)Cl}2](arene = C6H6, C6H5Me, or C6H3Me3-1,3,5) react with norbornadiene (nbd), cyclo-octa-1,3,5,7-tetraene(cot), or cyclohepta-1,3,5-triene (cht), and the corresponding cations [Mo(η-C3H5)(η-arene)(η-olefin)]+ have been is olated from the hydrolysed reaction mixtures. Prolonged reaction with cht yields the cycloheptatrienly sandwich compounds [Mo(η-C7H7)(η-arene)][PF6]. The comound

  紫色溶液形成形式（AlEtCl 2）2和化合物[沫（η-C 3 H ^ 5）（η-芳烃）氯} 2 ]（芳烃= C 6 H ^ 6，C 6 ħ 5 Me中，或C 6 H 3 Me 3 -1,3,5）与降冰片二烯（nbd），环辛-1,3,5,7-四烯（cot）或环庚-1,3,5-三烯（cht）反应，相应的阳离子[沫（η-C 3 H ^ 5）（η-芳烃）（η烯烃）] +已被从水解反应混合物olated。与CHT延长的反应产生了cycloheptatrienly夹心化合物[沫（η-C 7H 7）（η-芳烃）] [PF 6 ]。所述comound [沫（η-C 3 H ^ 5）（η-C 6 H ^ 6）（CHT）] [PF 6 ]经受在氧化铝柱上去质子化到中性化合物[沫（η-C 3 H ^ 5）（η -C 6 ħ 6）（η 3 -C 7 ħ 7）]。与在氯化锂或碱性连二亚硫酸钠的存在下，产物的环戊烯和水解的紫色溶液反应给出[沫（η-C