[Cu(2,9-dimethyl-1,10-phenanthroline)(H2O)2(phenylphosphonic acid-H)][phenylphosphonic acid-H] | 1161696-85-0

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 喹啉及其衍生物
• 英文名称: [Cu(2,9-dimethyl-1,10-phenanthroline)(H2O)2(phenylphosphonic acid-H)][phenylphosphonic acid-H]
• 英文别名: [Cu(dmp)(H2O)2(PhPO2(OH))][PhPO2(OH)]
• CAS: 1161696-85-0
• 化学式: C₆H₆O₃P*C₂₀H₂₂CuN₂O₅P
• 分子量: 622.01
• InChiKey: IJRVGGXBMGPISF-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：

  [Cu(2,9-dimethyl-1,10-phenanthroline)2]Cl*methanol*5H2O 、 苯膦酸 、 水 以 乙醇 为溶剂， 以29%的产率得到[Cu(2,9-dimethyl-1,10-phenanthroline)(H2O)2(phenylphosphonic acid-H)][phenylphosphonic acid-H]
  参考文献：
  名称：

  Synthesis, crystal structure and luminescent behaviour of coordination complexes of copper with bi- and tridentate amines and phosphonic acids

  摘要：

  amine phosphonate, complexes is reported. Reaction of copper(I) with 2-,9-dimethyl-1-10-phenanthroline (dmp) produced a stable 4-coordinate Cu(I) species, [Cu(I)(dmp)(2)] Cl center dot MeOH center dot 5H(2)O (2), i.e., the increased steric hindrance in the 'bite' area of dmp did not prevent interaction with the metal and provided protection against oxidation which was not possible for the phen analogue [R. Clarke, K. Latham, C. Rix, M. Hobday, J. White, CrystEngCommun. 7(3) (2005), 28-36]. Subsequent addition of phenylphosphonic acid to (2) produced two structures from alternative synthetic routes. An 'in situ' process yielded red block Cu(I) crystals, [Cu(I)(dmp)(2)] center dot [C6H5PO3H2 center dot C6H5PO3H] (4), whilst recrystallisation of (2) prior to addition of the acid ('stepwise' process) produced a green, needle-like Cu(II) complex, [Cu(II)(dmp) center dot (H2O)(2) center dot C6H5PO2(OH)] [C6H5PO2(OH)] (3). However, addition of excess dmp during the 'stepwise' process forced the equilibrium towards product (4) and resulted in an optimum yield (99%). The structure of (4) was similar to the phen analogue, [Cu(II)Cl(phen)(2)] center dot [C6H5PO2(OH) center dot C6H5PO(OH)(2)] (1) [R. Clarke, K. Latham, C. Rix, M. Hobday, J. White, CrystEngCommun. 7(3) (2005), 28-36], but the presence of dmp exerted some influence on global packing, whilst (3) exists as a polymeric layered material. In contrast, reaction of copper(I) with di-2-pyridyl ketone (dpk), followed by phenylphosphonic acid produced purple/blue Cu(II) species, [Cu(II)(dpk center dot H2O)(2)]Cl-2 center dot 4H(2)O (5), and [Cu(II)(dpk center dot H2O) 2] center dot [ C6H5PO2(OH) 2 center dot C6H5PO(OH)(2)] (6), respectively, i.e., in both cases oxidation of copper occurred. Solid-state luminescence was observed in (2) and (4). The latter showing a 5-fold enhancement in intensity. (c) 2008 Elsevier B.V. All rights reserved.

  DOI：

  10.1016/j.ica.2008.09.010