1-(3,4-dicarboxyphenyl)-4-hydroxypyridin-1-ium chloride | 1446198-07-7

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 吡啶及其衍生物
• 英文名称: 1-(3,4-dicarboxyphenyl)-4-hydroxypyridin-1-ium chloride
• 英文别名: 1-(3,4-Dicarboxyphenyl)-4-hydroxypyridinium chloride；4-(4-hydroxypyridin-1-ium-1-yl)phthalic acid;chloride
• CAS: 1446198-07-7
• 化学式: C₁₃H₁₀NO₅*Cl
• 分子量: 295.679
• InChiKey: SFKAMROWPBQWOG-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  -1.93
• 重原子数：
  20
• 可旋转键数：
  3
• 环数：
  2.0
• sp3杂化的碳原子比例：
  0.0
• 拓扑面积：
  98.7
• 氢给体数：
  3
• 氢受体数：
  6

反应信息

• 作为反应物：
  描述：

  dysprosium(III) nitrate hexahydrate 、 1-(3,4-dicarboxyphenyl)-4-hydroxypyridin-1-ium chloride 在 sodium formate 、 硝酸 作用下， 以 水 为溶剂， 反应 72.33h， 以45%的产率得到
  参考文献：
  名称：

  Lanthanide coordination polymers based on multi-donor ligand containing pyridine and phthalate moieties: Structures, luminescence and magnetic properties

  摘要：

  A new family of five lanthanide-organic coordination polymers incorporating multi-functional N-hetrocyclic dicarboxylate ligand, namely, [Ln(2)(Hdpp)(2)(dpp)(2)](n) Ln=Pr(1), Eu(2), Gd(3), Dy(4), Er(5) (H(2)dpp= 1-(3, 4-dicarboxyphenyl) pyridin-4-ol) have been fabricated successfully through solvothermal reaction of 1-(3,4-dicarboxyphenyl)-4-hydroxypyridin-1-ium chloride with trivalent lanthanide salts, and have been characterized systematically. The complexes 1-5 are isomorphous and isostructural. They all feature three dimensional (3D) frameworks based on the interconnection of 1D double chains composed of the binuclear moiety [Ln(2)(Hdpp)(2)](4+) basic carboxylate as secondary building unit (SBU). The results of magnetic analysis shows the same bridging fashion of carboxylic group in this case results in the different magnetic properties occurring within lanthanide polymers. Moreover, the Eu(III) and Dy(III) complexes display characteristic luminescence emission in the visible regions. (C) 2013 Elsevier Inc. All rights reserved.

  DOI：

  10.1016/j.jssc.2013.08.029

文献信息

• A series of 3D lanthanide frameworks constructed from aromatic multi-carboxylate ligand: Structural diversity, luminescence and magnetic properties
  作者：Xun Feng、Xun-Li Ling、Lang Liu、Hong-Liang Song、Li-Ya Wang、Seik-Weng Ng、Bei Ya Su

  DOI：10.1039/c3dt50810b

  日期：——

  Reactions of lanthanide(III) nitrates with multi-donor carboxylate ligand in the presence of oxalate anion afforded four new lanthanide coordination polymers with three dimensional (3D) frameworks, namely, [Ln2(DPPA)2(μ2-C2O4)(H2O)2]·2H2O}n (Ln = Nd (1), Sm (2)) and [Ln2(HDPPA)2(DPPA)2]n (Ln = Tb (3), Yb (4)), (H3DPPA = 3-(4-hydroxyl pyridinium-1-yl) phthalic acid and H2C2O4 = oxalic acid). Compounds 1 and 2 are isostructural and isomorphous, featuring oxalate pillared binodal (4,5)-connected porous 3D framework with intersected 1D channels, in which the coordinated and lattice waters are accommodated. The complexes 3 and 4 are also isostructural, but featuring a (4,6)-connected 3D network based on a rectangular window composed of Ln(HDPPA)}+ extended anion chains, further interlinked by DPPA. The Tb(III) analogue exhibits intense characteristic green photoluminescence employing DPPA as an antenna. While Sm(III) compound 2 mainly involves ligand-to-ligand charge transfer. Variable-temperature susceptibility analyses of complexes 1 (Nd), 2 (Sm) and 3 (Tb) revealed that depopulation of the Stark levels together with weak antiferromagnetic interactions between the lanthanide ions lead to a continuous decrease in χMT when the samples are cooled from 300 to 2 K.

  在草酸盐阴离子存在下，镧系元素（III）硝酸盐与多供体羧酸配体发生反应，产生了四种具有三维（3D）框架的新型镧系元素配位聚合物、即[Ln2(DPPA)2(μ2-C2O4)(H2O)2]-2 }n（Ln = Nd (1)，Sm (2)）和[Ln2(HDPPA)2(DPPA)2]n（Ln = Tb (3)，Yb (4)）（H3DPPA = 3-(4-羟基吡啶-1-基)邻苯二甲酸，H2 = 草酸）。化合物 1 和 2 具有同构和同形结构，其特征是草酸柱状双十二(4,5)连接多孔三维框架具有相交的一维通道，其中容纳了配位水和晶格水。复合物 3 和 4 也是同结构的，但其特征是基于由 Ln(HDPPA)}+ 扩展阴离子链组成的矩形窗口的 (4,6)- 连接的三维网络，并通过 DPPA 进一步相互连接。利用 DPPA 作为天线，锑（III）类似物显示出强烈的绿色光致发光特性。而 Sm（III）化合物 2 主要涉及配体与配体之间的电荷转移。对复合物 1（钕）、2（钐）和 3（铽）的变温电感分析表明，当样品从 300 K 冷却到 2 K 时，斯塔克电平的去占位以及镧系元素离子之间微弱的反铁磁相互作用导致了 χMT 的持续下降。