nickel(II) tetrakis(p-CF3-phenyl)porphyrin | 528880-56-0

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 吡咯
• 英文名称: nickel(II) tetrakis(p-CF3-phenyl)porphyrin
• CAS: 528880-56-0
• 化学式: C₄₈H₂₄F₁₂N₄Ni
• 分子量: 943.416
• InChiKey: OYEXBTBWCQVOML-DAJBKUBHSA-N

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：

  nickel(II) tetrakis(p-CF3-phenyl)porphyrin 在 N-溴代丁二酰亚胺(NBS) 、 silica gel 作用下， 以55 %的产率得到nickel(II)-β-octabromo-meso-tetra-(p-trifluoromethylphenyl)-porphyrin
  参考文献：
  名称：

  室温下镍（II）卟啉的机械化学β-卤化

  摘要：

  传达了一种室温和无溶剂的β-氯化和β-溴化内消旋-四芳基卟啉镍 (II) 配合物通过球磨获得β-八卤化衍生物的方案。系统地研究了各种球磨参数。

  DOI：

  10.1002/jccs.202300055
• 作为产物：
  描述：

  5,10,15,20-tetrakis(4-trifluoromethylphenyl)porphyrin 、 nickel dichloride 以 甲醇 、 二氯甲烷 为溶剂， 以61%的产率得到nickel(II) tetrakis(p-CF3-phenyl)porphyrin
  参考文献：
  名称：

  Synthesis, spectral, structural and antimicrobial studies of fluorinated porphyrins

  摘要：

  We have reported the synthesis, spectral and anti-microbial studies of 5,10,15,20-tetrakis(4'-trifluoromethylphenyl)porphyrin derivatives, MT(4'-CF3P)Ps where M = 2H, 1; Fe(II), 2; Ni(II), 3; Cu(II), 4; Zn(II), 5 and Pt(II), 6. The optical absorption and steady state fluorescence spectra of 1-6 show characteristic bands comparable with MTPPs. Compounds 1 and 3-5 were structurally characterized using single crystal X-ray diffraction analysis; 1 and 4 crystallized in the triclinic system, whereas 3 and 5 in the monoclinic system. The high spin nickel(II) ion in 3 is well placed at the center of the planar porphyrin core, which is influenced by the presence of trifluoromethylphenyl groups at the periphery and two THF molecules in apex positions. The porphyrins I and 3-5 are arranged in a slip-stacked fashion involving C-H center dot center dot center dot pi and C-F center dot center dot center dot H-(sol) intermolecular close contacts for 1, 4 and 3, 5, respectively. The role of non-covalent interactions involving the trifluoromethylphenyl groups in the crystal packing have been analyzed and quantified using Hirshfeld surface analysis. The antimicrobial activity of the free ligand is higher compared to its metal complexes. (C) 2015 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.poly.2015.05.018

文献信息

• Synthesis of Calix[3]dipyrrins by a Modified Lindsey Protocol
  作者：Mitsunori Inoue、Chusaku Ikeda、Yuji Kawata、Sundararaman Venkatraman、Ko Furukawa、Atsuhiro Osuka

  DOI：10.1002/anie.200604882

  日期：2007.3.19