[(pentamethylcyclopentadienyl)RhCl2(1-boranyl-1,3,5-triaza-7-phosphaadamantane)2]Cl | 1046796-92-2

• 英文名称: [(pentamethylcyclopentadienyl)RhCl2(1-boranyl-1,3,5-triaza-7-phosphaadamantane)2]Cl
• CAS: 1046796-92-2
• 化学式: C₂₂H₄₅B₂ClN₆P₂Rh*Cl
• 分子量: 651.021
• InChiKey: PNLRESVPUBFWSH-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

• 作为反应物：
  描述：

  [(pentamethylcyclopentadienyl)RhCl2(1-boranyl-1,3,5-triaza-7-phosphaadamantane)2]Cl 以 二甲基亚砜 为溶剂， 生成 [(pentamethylcyclopentadienyl)RhCl2(1-boranyl-1,3,5-triaza-7-phosphaadamantane)]
  参考文献：
  名称：

  Synthesis and reactivity of rhodium(III) pentamethylcyclopentadienyl complexes of N–B–PTA(BH3): X-ray crystal structures of [Cp∗RhCl2{N–B}–PTA(BH3)] and [Cp∗Rh{N–B–PTA(BH3)}(η2-CH2=CHPh)]

  摘要：

  The reaction between 1-boranyl-1,3,5-triaza-7-phosphaadamantane ligand N-B-PTA(BH(3)) and [Cp*RhCl(mu-Cl)](2) affords [Cp*Rh{N-B-PTA(BH(3))}Cl(2)] (3) or [Cp*Rh{N-B-PTA(BH(3))}(2)Cl]Cl (5) containing one or two P-bonded boronated PTA ligands. The hydride [Cp*Rh{N-B-PTA(BH(3))}H(2)] (8) was also obtained by reaction of 3 with NaBH(4) and alternatively by direct hydroboration of [Cp*Rh(PTA)Cl(2)] with excess NaBH(4). Moderately slow hydrolysis of the N-boranyl rhodium complexes affords dihydrogen, H(3)BO(3) and the corresponding PTA derivatives, including the water-soluble dihydride [Cp*Rh(PTA)H(2)] (9). Finally, the reaction of 8 with electron poor alkynes gives the alkene complexes [Cp*Rh{N-B-PTA(BH(3))}(eta(2)-CH(2) = CHR)] (R = Ph, 10; C(O)OEt, 11) as a mixture of rotamers eta(2)-coordinated to rhodium without affecting the N-BH(3) moiety. The X-ray crystal structures of 3 and 10 were also obtained and are here discussed. (C) 2008 Elsevier B. V. All rights reserved.

  DOI：

  10.1016/j.jorganchem.2008.04.006
• 作为产物：
  描述：

  1-boranyl-1,3,5-triaza-7-phosphaadamantane 、 [(pentamethylcyclopentadienyl)RhCl2(1-boranyl-1,3,5-triaza-7-phosphaadamantane)] 以 二氯甲烷 为溶剂， 生成 [(pentamethylcyclopentadienyl)RhCl2(1-boranyl-1,3,5-triaza-7-phosphaadamantane)2]Cl
  参考文献：
  名称：

  Synthesis and reactivity of rhodium(III) pentamethylcyclopentadienyl complexes of N–B–PTA(BH3): X-ray crystal structures of [Cp∗RhCl2{N–B}–PTA(BH3)] and [Cp∗Rh{N–B–PTA(BH3)}(η2-CH2=CHPh)]

  摘要：

  The reaction between 1-boranyl-1,3,5-triaza-7-phosphaadamantane ligand N-B-PTA(BH(3)) and [Cp*RhCl(mu-Cl)](2) affords [Cp*Rh{N-B-PTA(BH(3))}Cl(2)] (3) or [Cp*Rh{N-B-PTA(BH(3))}(2)Cl]Cl (5) containing one or two P-bonded boronated PTA ligands. The hydride [Cp*Rh{N-B-PTA(BH(3))}H(2)] (8) was also obtained by reaction of 3 with NaBH(4) and alternatively by direct hydroboration of [Cp*Rh(PTA)Cl(2)] with excess NaBH(4). Moderately slow hydrolysis of the N-boranyl rhodium complexes affords dihydrogen, H(3)BO(3) and the corresponding PTA derivatives, including the water-soluble dihydride [Cp*Rh(PTA)H(2)] (9). Finally, the reaction of 8 with electron poor alkynes gives the alkene complexes [Cp*Rh{N-B-PTA(BH(3))}(eta(2)-CH(2) = CHR)] (R = Ph, 10; C(O)OEt, 11) as a mixture of rotamers eta(2)-coordinated to rhodium without affecting the N-BH(3) moiety. The X-ray crystal structures of 3 and 10 were also obtained and are here discussed. (C) 2008 Elsevier B. V. All rights reserved.

  DOI：

  10.1016/j.jorganchem.2008.04.006