[NBu4][(C6F5)2Pd(η2-SC(NEt2)NPh)] | 726157-43-3

• 分子结构分类: 有机化合物 - 有机氮化合物
• 英文名称: [NBu4][(C6F5)2Pd(η2-SC(NEt2)NPh)]
• 英文别名: N,N-diethyl-N'-phenylcarbamimidothioate;palladium(2+);1,2,3,4,5-pentafluorobenzene-6-ide;tetrabutylazanium
• CAS: 726157-43-3
• 化学式: C₁₆H₃₆N*C₂₃H₁₅F₁₀N₂PdS
• 分子量: 890.324
• InChiKey: HYHKJGVRNVKQMS-UHFFFAOYSA-M

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：

  [tetrabutylammonium]2[(Pd(pentafluorophenyl)2(μ-hydroxo))2] 、 硫代异氰酸苯酯 、 二乙胺 以 二氯甲烷 为溶剂， 以82%的产率得到[NBu4][(C6F5)2Pd(η2-SC(NEt2)NPh)]
  参考文献：
  名称：

  New thiocarbamate and thioureate palladium and platinum complexes: synthesis and use as metalloligands. Unprecedented coordination of the thioureate ligand in [(C6F5)2Pd{μ2,η2-SC(NMe2)NPh}Pd(C6F5)(bpzm)]

  摘要：

  The di-mu-hydroxo complexes [NBu4](2)[{(C6F5)(2)M(mu-OH)}(2)] (M = Pd, Pt) react with PhNCS in alcohol ROH solution to yield the N,S-chelating thiocarbarnate metal complexes [NBu4][(C6F5)(2)M{eta(2)-SC(OR)NPh}] (R = Me, Et or Pr-n). [NBu4](2)[{(C6F5)(2)Pd(mu-OH)}(2)] also reacts with PhNCS in the presence of dialkylamines R2NH to yield the N,S-chelating thioureate (1-) palladium complexes [NBu4][(C6F5)(2)Pd{eta(2)-SC(NR2)NPh}] (R = Me or Et). [NBu4][(C6F5)(2)M{eta(2)-SC(X)NPh}] (M = Pd or Pt; X = OMe or NR2) reacts with [(C6F5)Pd(bpzm)(acetone)]ClO4 to yield the dinuclear complexes [(C6F5)(2)M{mu(2), eta(2)-SC(X)NPh}Pd(C6F5)(bpzm)] (M = Pd or Pt, X = OMe or NR2; bpzm = bis(3,5-dimethylpyrazol-1-yl)methane). The single-crystal structures of [NBu4][(C6F5)(2)Pd{eta(2)-SC(OMe)NPh}] and [(C6F5)(2)Pd{mu(2), eta(2)-SC(NMe2)NPh}Pd(C6F5)(bpzm)] have been established by X-ray diffraction. (C) 2004 Elsevier B.V. All rights reserved.

  DOI：

  10.1016/j.ica.2004.01.010