[Mo(N(adamantyl))2(2,6-bis(2-hydroxy-2,2-diphenylethyl)pyridine(-2H))]*MeCN | 949156-68-7

• 英文名称: [Mo(N(adamantyl))2(2,6-bis(2-hydroxy-2,2-diphenylethyl)pyridine(-2H))]*MeCN
• CAS: 949156-68-7
• 化学式: C₂H₃N*C₅₃H₅₇MoN₃O₂
• 分子量: 905.047
• InChiKey: WHKJQDAJNLEQBH-RZHDDDLSSA-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

• 作为产物：
  描述：

  [Mo(N(adamantyl))(NC6F5)Cl2(dme)] 、 2,6-bis(2,2-diphenyl-2-hydroxyethyl)pyridine 、 乙腈 、 lithium tert-butoxide 以 乙醚 为溶剂， 以89%的产率得到[Mo(N(adamantyl))2(2,6-bis(2-hydroxy-2,2-diphenylethyl)pyridine(-2H))]*MeCN
  参考文献：
  名称：

  ‘Electronic bending’ of imido ligands and the effect on the coordination mode of a tridentate ancillary ligand

  摘要：

  The five-coordinate mixed-imido complex [Mo(Nt-Bu)(NC6F5)(L)] (1) can be prepared in high yield via treatment of [Mo(Nt-Bu)(NC6F5)(Ot-Bu)(2)] with LH2, where LH2 is 2,6-bis(2-hydroxy-2,2-diphenylethyl)pyridine. Contrastingly, the reaction of [Mo(NAd)(2)(NC6F5)(Ot-Bu)(2)] (Ad = adamantyl, C-6-H-10) with LH2 gave [Mo(NAd)(2)(L)] (2) via an imido-exchange reaction. Complex 2 can also be synthesised via treatment of in situ generated [Mo(NAd)(2)(Ot-Bu)(2)] with LH2; the latter method also results in trace amounts of the five-coordinate complex [MoCl(NAd)(2)(L-dehyd)] (3) (L-dehyd = 2-(2-hydroxy-2,2-diphenylethenyl)pyridine). The structures of 1-3 have been determined by X-ray crystallographic study. In each complex, the geometry at the metal is distorted trigonal bipyramidal with the pyridinediolate ligand adopting an 'aea' bonding arrangement in I and an 'eee' arrangement in 2. The angle associated with the imido moiety also varies, with the greatest deviations found in 1 and 3, indeed, the pentafluoroimido ligand in I has one of the largest deviations from linearity for an M-N-C angle recorded to-date [135.98(16)degrees]. This has been rationalised on the basis of an electronic effect rather than intramolecular steric interactions or crystal packing forces. (c) 2007 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.poly.2007.02.008