Cd2(ethyl 2-methyl-5-(prop-1-en-2-yl)pyrido[2,3-a]phenazine-3-carboxylate)2Cl4 | 1610773-22-2

• 英文名称: Cd2(ethyl 2-methyl-5-(prop-1-en-2-yl)pyrido[2,3-a]phenazine-3-carboxylate)2Cl4
• 英文别名: Cd₂(ethyl 2-methyl-5-(prop-1-en-2-yl)pyrido[2,3-a]phenazine-3-carboxylate)₂Cl₄
• CAS: 1610773-22-2
• 化学式: C₄₄H₄₂Cd₂Cl₄N₆O₄
• 分子量: 1085.49
• InChiKey: KCMLJTZGXJALHG-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  None
• 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：

  aqueous cadmium chloride 、 ethyl 2-methyl-5-(prop-1-en-2-yl)pyrido[2,3-a]phenazine-3-carboxylate 以 乙醇 为溶剂， 反应 0.67h， 以30%的产率得到Cd2(ethyl 2-methyl-5-(prop-1-en-2-yl)pyrido[2,3-a]phenazine-3-carboxylate)2Cl4
  参考文献：
  名称：

  Synthesis, structure and photoluminescence of Zn(II) and Cd(II) complexes with pyridophenazine derivative

  摘要：

  The (ZnLCl2] (1) and Cd2L2Cl4 (2) complexes, where L is ethyl 2-methyl-5-(prop-1-en-2-yl)pyrido[2,3-alphenazine-3-carboxylate, were synthesized. The complexes were characterized by elemental analyses, H-1 and C-13 NMR spectroscopy, and X-ray powder diffraction. Single crystals of 1 and [Cd2L2Cl4].4CH(2)Cl(2) (3) have been grown. The structure of 1 consists of mononuclear molecules, while the structure of 3 is built up of centrosymmetrical binuclear [Cd2L2Cl4] complex molecules and uncoordinated CH2Cl2 molecules. In 1 and 3, L acts as a bidentate chelating ligand. There is five-membered ZnN2C2 chelate cycle in the [ZnLCl2] molecule. There are two five-membered CdN2C2 chelate cycles and a Cd2Cl2 dinuclear unit in the molecule of [Cd2L2Cl4]. The coordination polyhedra are distorted tetrahedron Cl2N2 (in the structure 1) and distorted tetragonal pyramid Cl3N2 (in the structure of 3). According to IR-spectroscopic data, complex 2 is binuclear. Complexes 1 and 2 display bright luminescence in CHCl3 solutions (lambda(max) = 477 and 475 nm, respectively) and in the solid state (lambda(max) = 510 and 529 nm, respectively). The free L ligand shows weak luminescence intensity (lambda(max) = 441 and 467 nm in CHCl3 and solid state, respectively). (C) 2014 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.poly.2014.04.011