[PdCl(κ3-C6H3-1,3-(CH2SC6H4F-4)2)] | 912133-42-7

• 英文名称: [PdCl(κ3-C6H3-1,3-(CH2SC6H4F-4)2)]
• 英文别名: [Pd(C6H3-2,6-(CH2SC6H4F-4)2)Cl]；[PdCl(SCS-C6H4F-4)]
• CAS: 912133-42-7
• 化学式: C₂₀H₁₅ClF₂PdS₂
• 分子量: 499.341
• InChiKey: DFECBBYTRQOGEA-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

• 作为反应物：
  描述：

  吡嗪 、 [PdCl(κ3-C6H3-1,3-(CH2SC6H4F-4)2)] 、 silver tetrafluoroborate 以 四氢呋喃 为溶剂， 以85%的产率得到[Pd(C6H3-2,6-(CH2SC6H4F-4)2)(pyrazine)Pd(C6H3-2,6-(CH2SC6H4F-4)2)][BF4]2
  参考文献：
  名称：

  Binuclear cyclopalladated pincer compounds bridged by ditopic nitrogenated ligands

  摘要：

  The binuclear cyclopalladated compounds [(SCS)Pd-pz-Pd(SCS)][BF4](2) (pz = pyrazine) 2a, [(SCS)Pd-bipy-Pd(SCS)][BF4](2) (bipy = 4,4'-bipyridine) 2b, [(SCS)Pd-dcb-Pd(SCS)][BF4](2) (dcb = 1,4-dicyanobenzene) 2c and [(SCS)Pd-tmeda-Pd(SCS)][BF4](2) (tmeda = N,N,N',N'-tetramethylethylenediamine) 2d (SCS = {C6H3-2,6-(CH2SC6H4F-4)(2)}) were synthesized by a substitution reaction between the pincer unit [Pd(C6H3-2,6-(CH2SC6H4F-4)(2))Cl] 1 and the corresponding bidentate nitrogenated ligands. The topology of the bridging ligand between both pincer units induces the aggregation of the organometallic cations in the solid state. The X-ray diffraction molecular structures of complexes 2a and 2d are also reported. (C) 2011 Elsevier B.V. All rights reserved.

  DOI：

  10.1016/j.ica.2011.07.019
• 作为产物：
  描述：

  C6H4-1,3-(CH2SC6H4F-4)2 、 乙腈 、 sodium chloride 、 palladium dichloride 在 AgBF₄ 作用下， 以 乙腈 为溶剂， 以68%的产率得到[PdCl(κ3-C6H3-1,3-(CH2SC6H4F-4)2)]
  参考文献：
  名称：

  Palladium( II ) Compounds with Fluorinated Pincer‐Type (SCS) Ligands: X‐ray Structures of C ₆ H ₄ ‐1,3‐(CH ₂ SC ₆ H ₄ F‐4) ₂ and [PdCl(SCS–R _f )] [R _f = C ₆ H ₄ F‐2, C ₆ H ₄ F‐3, C ₆ H ₄ F‐4, C ₆ H ₄ (CF ₃ )‐2, and C ₆ H ₄ (CF ₃ )‐4]

  摘要：

  AbstractMetathesis reactions employing lead fluorothiolates and C6H4‐1,3‐(CH2Br)2 afford the corresponding pincer‐type dithioether ligands C6H4‐1,3‐(CH2SRf)2 [Rf = C6H4F‐2 (L1), C6H4F‐3 (L2), C6H4F‐4 (L3), C6H4CF3‐2 (L4), C6H4CF3‐3 (L5), and C6H4CF3‐4 (L6)]. A series of PdII pincer‐type complexes [PdCl(κ3‐Ln)], 1 to 6, were prepared and fully characterized. The X‐ray diffraction molecular structures of C6H4‐1,3‐[CH2S(C6H4F‐4)]2 (L3), [PdCl(SCS–C6H4F‐2)] (1), [PdCl(SCS–C6H4F‐3)] (2), [PdCl(SCS–C6H4F‐4)] (3), [PdCl{SCS–C6H4(CF3)‐2}] (4), and [PdCl{SCS–C6H4(CF3)‐4}] (6) are also reported. (© Wiley‐VCH Verlag GmbH & Co. KGaA, 69451 Weinheim, Germany, 2006)

  DOI：

  10.1002/ejic.200500818