trans-chloro(2-nitrobenzenethiolato-S)bis(triphenylphosphine-P)-palladium(II) monoacetone | 293295-78-0

• 英文名称: trans-chloro(2-nitrobenzenethiolato-S)bis(triphenylphosphine-P)-palladium(II) monoacetone
• CAS: 293295-78-0
• 化学式: C₃H₆O*C₄₂H₃₄ClNO₂P₂PdS
• 分子量: 878.704
• InChiKey: YDUCSIDBVSMRSP-UHFFFAOYSA-L

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：

  丙酮 、 、 trans-bis(triphenylphosphine)palladium dichloride 以 丙酮 为溶剂， 生成 trans-chloro(2-nitrobenzenethiolato-S)bis(triphenylphosphine-P)-palladium(II) monoacetone
  参考文献：
  名称：

  trans-Chloro(2-nitrobenzenethiolato-S)bis(triphenylphosphine-P)palladium(II) monoacetone solvate

  摘要：

  Molecules of the title compound, [PdCl(C6H4NO2S)(PPh3)(2)] .- C3H6O, exhibit a slight distortion from exact planarity at the Pd atom towards tetrahedral, with P-Pd-P and Cl-Pd-S angles of 174.98 (3) and 174.19 (3)degrees, respectively. The Pd-Cl and Pd-S bonds are, respectively, long [2.3550 (11) Angstrom] and short [2.3020 (12) Angstrom] for their types; the S-C bond is also very short [1.744 (4) Angstrom]. The solvating acetone molecule is linked to one of the phosphine ligands by means of a CD H ... O hydrogen bond.

  DOI：

  10.1107/s0108270100007320