(p-cymene)RuCl2(PPh2(NC4H4)) | 200133-63-7

• 分子结构分类: 有机化合物 - 脂质和类脂质分子 - 异戊烯醇脂质
• 英文名称: (p-cymene)RuCl2(PPh2(NC4H4))
• 英文别名: dichlororuthenium;diphenyl(pyrrol-1-yl)phosphane;1-methyl-4-propan-2-ylbenzene
• CAS: 200133-63-7
• 化学式: C₂₆H₂₈Cl₂NPRu
• 分子量: 557.465
• InChiKey: HHROFFQJJXDLQZ-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：

  [ruthenium(II)(η⁶-1-methyl-4-isopropyl-benzene)(chloride)(μ-chloride)]₂ 、 N-(diphenylphosphino)pyrrole 以 二氯甲烷 为溶剂， 以81%的产率得到(p-cymene)RuCl2(PPh2(NC4H4))
  参考文献：
  名称：

  Solution Thermochemical and Structural Studies of Ligand Substitution of N-Pyrrolyl Phosphine Ligands in the (p-cymene)RuCl₂(PR₃) System

  摘要：

  The enthalpies of reaction of [(p-cymene)RuCl2](2) (p-cymene = (CH3)(2)CHC6H4CH3) With a series of N-substituted tertiary phosphine ligands, leading to the formation of (p-cymene)RuCl2(PR3) complexes (PR3 = tertiary phosphine) have been measured by solution calorimetry in CH2Cl2 at 30 degrees C. The overall relative order of stability, within this series, is as follows: P(NC4H4)(3) < P(NC4H4)(2)(C6H5) < P(NC4H4)(C6H5)(2) < P(NC4H8)(3). Structural studies have been performed on three complexes in the (p-cymene)RuCl2(PR3) system, PR3 = P(NC4H4)(3), P(NC4H4)(2)(C6H5), and PBz(3). Thermochemical and structural data are compared to provide an understanding of the bonding involving these N-pyrrolyl-substituted phosphine ligands.

  DOI：

  10.1021/om970809t