[Co(dibenzoylmethane-H)2(2,4,6-tris(4-pyridyl)-1,3,5-triazine)](n)*nTHF | 949573-41-5

• 分子结构分类: 有机化合物 - 有机杂环化合物
• 英文名称: [Co(dibenzoylmethane-H)2(2,4,6-tris(4-pyridyl)-1,3,5-triazine)](n)*nTHF
• 英文别名: [Co(dibenzoylmethane-H)2(2,4,6-tris(4-pyridyl)-1,3,5-triazine)](n)*0.75nTHF
• CAS: 949573-41-5
• 化学式: C₄H₈O*C₄₈H₃₄CoN₆O₄
• 分子量: 889.936
• InChiKey: FIKNKQIFBRFWQQ-UHFFFAOYSA-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

• 作为产物：
  描述：

  四氢呋喃 、 2,4,6-三(4-吡啶)1,3,5-三嗪 、 [Co(dibenzoylmethane-H)2(MeOH)2] 以 氯仿 为溶剂， 以20%的产率得到[Co(dibenzoylmethane-H)2(2,4,6-tris(4-pyridyl)-1,3,5-triazine)](n)*nTHF
  参考文献：
  名称：

  Preparation and Structure of Three Solvatomorphs of the Polymer [Co(dbm)₂(4ptz)]_n:  Spin Canting Depending on the Supramolecular Organization

  摘要：

  The syntheses and X-ray structures of three isomeric ID coordination polymers are reported. The complex [Co(dbM)(2)(MeOH)(2)] (1) was used as a precursor in these reactions. The preparation and structure of 1 is also presented; this mononuclear complex is in the cis configuration because this allows the formation of a network of intermolecular hydrogen bonds in the solid state. Reaction of 1 with 2,4,6-tris-(4-pyridyl)-1,3,5-triazine (4ptz) yields the polymers [Co(dbm)(2)(4ptz)](n).nTHF (2a), [Co(dbM)(2)(4ptZ)]n.0.75nTHF.0.5nEt(2)O (2b), and [Co(dbM)(2)(4ptZ)(n).3nDMF (2c) in the form of zigzag chains, instead of the expected honeycomb architectures. This is because of the establishment of extended pi-pi T stacking throughout these solids, which could not have occurred otherwise. Compounds 2a, 2b, and 2c are solvatomorphs, and formation of either one of them depends on the exact conditions of crystallization, which lead to significant differences in the supramolecular organization of the chains. Bulk magnetic measurements on 2a reveal weak antiferromagnetic exchange within the chains and small ordering throughout the solid that results in the manifestation of the phenomenon of spin canting, whereas for 2c the different supramolecular organization causes the antiferromagnetic exchange not to result in spin canting.

  DOI：

  10.1021/ic7004979