ReO(2,2'-bipyridine)(p-CH3C6H4S)3 | 606125-70-6

• 分子结构分类: 有机化合物 - 苯类化合物 - 苯和取代衍生物
• 英文名称: ReO(2,2'-bipyridine)(p-CH3C6H4S)3
• CAS: 606125-70-6
• 化学式: C₃₁H₂₉N₂OReS₃
• 分子量: 727.989
• InChiKey: ZYFCOOYAJLMQRU-UHFFFAOYSA-K

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：

  2,2'-联吡啶 、 [ReOCl₃(PPh₃)₂] 、 N-乙酰-L-半胱氨酸 、 4-甲苯硫酚 在 sodium acetate 作用下， 以 甲醇 为溶剂， 以17%的产率得到ReO(2,2'-bipyridine)(p-CH3C6H4S)3
  参考文献：
  名称：

  Synthesis and structural characterization of a novel Re[P][NN][S][SO] mixed ligand rhenium(III) complex

  摘要：

  A novel mixed ligand hexacoordinated rhenium(III) complex of the general formula Re-III[P][NN][S][SO] has been synthesized by reacting (ReOCl3)-O-V(PPh3)(2) with 2,2'-bipyridine (NN), p-thiocresol (S) and N-acetyl-L-cysteine (SO) in a 1: 1: 1: 1 ratio in methanol. During the reaction, the central rhenium atom undergoes reduction from Re(V) to Re(III). The complex was isolated as red crystals and characterized by elemental analysis, IR and NMR spectroscopies. X-ray crystallographic studies showed that the coordination geometry around rhenium is distorted octahedral. The equatorial plane is defined by the two nitrogen atoms of 2,2'-bipyridine, the sulfur of N-acetyl-L-cysteine and the sulfur of the aromatic thiol, while the phosphorous and the carboxylate oxygen of N-acetyl-L-cysteine occupy the apical positions. (C) 2002 Elsevier Science B.V. All rights reserved.

  DOI：

  10.1016/s0020-1693(02)01377-4