4-pyrid-5-(1H-1,2,4-triazol-3-yl)-1,2,4-triazolyl | 1528792-35-9

• 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: 4-pyrid-5-(1H-1,2,4-triazol-3-yl)-1,2,4-triazolyl
• 英文别名: 5-(4-pyridyl)-3,3'-bis (1,2,4-triazole)；5-(Pyridin-4-yl)-2H,2'H-3,3'-bi(1,2,4-triazole)；4-[5-(1H-1,2,4-triazol-5-yl)-1H-1,2,4-triazol-3-yl]pyridine
• CAS: 1528792-35-9
• 化学式: C₉H₇N₇
• 分子量: 213.201
• InChiKey: ZMUCAMNQPBPEPV-UHFFFAOYSA-N

物化性质

• 沸点：
  608.9±57.0 °C(Predicted)
• 密度：
  1.493±0.06 g/cm3(Predicted)

计算性质

• 辛醇/水分配系数(LogP)：
  0.3
• 重原子数：
  16
• 可旋转键数：
  2
• 环数：
  3.0
• sp3杂化的碳原子比例：
  0.0
• 拓扑面积：
  96
• 氢给体数：
  2
• 氢受体数：
  5

反应信息

• 作为反应物：
  描述：

  phosphomolybdic acid 、 4-pyrid-5-(1H-1,2,4-triazol-3-yl)-1,2,4-triazolyl 、 silver nitrate 在 盐酸 作用下， 以 水 为溶剂， 反应 144.0h， 以35%的产率得到[Ag3(4-pyrid-5-(1H-1,2,4-triazol-3-yl)-1,2,4-triazolyl)4][PMo12O40]
  参考文献：
  名称：

  Assembly of Polyoxometalate-Based Hybrids with Different Helical Channels upon Subtle Ligand Variation

  摘要：

  Self-assembly of multiple components into well-defined and predictable structures remains one of the foremost challenges in chemistry. Here, upon subtle ligand variation, we reported on the assembly of three new polyoxometalate-based organic inorganic hybrid compounds with different helical channel, [Ag-3(H(2)pyttz-I)(2)] [PMo12O40] (1), [Ag-6(H(2)pyttz-II)(4)] [CoW12O40]center dot 2H(2)O (2), and [Ag-7(Hpyttz-II)(3)(H(2)pyttz-II)][GeW12O40]center dot 7H(2)O (3) (H(2)pyttz-I/II = 4-/ 3-pyrid-5-(1H-1,2,4-triazol-3-yl)-1,2,4-triazolyl, POM = polyoxometalates). X-ray diffraction analysis shows that compound 1 is constructed by "butterfly-like" Ag-5(H(2)pyttz-I)(2) subunits and POMs clusters, which are assembled into close helical channels impregnated with the components selves. Both compounds 2 and 3 are constructed by "paddle-wheel like" Ag-4(H(2)pyttz-II)(4) motifs and POMs clusters, which bring into being the larger helical channels (10.5% and 12.5% of the cell volume, respectively). Note that the only difference in compounds 2 and 3 is that the former contains 1D metal-organic chain structure, and the latter contains 2D metal-organic layer structure. In addition, the photocatalytic degradation of RhB by these compounds was also investigated.

  DOI：

  10.1021/cg500045q

文献信息

• Tuning the Helical Structures of Wells–Dawson Polyoxometalate Based Hybrid Compounds by Using Isomeric Ligands
  作者：Pei-Pei Zhu、Long-Jiang Sun、Ning Sheng、Jing-Quan Sha、Guo-Dong Liu、Lian Yu、Hong-Bin Qiu、Shu-Xian Li

  DOI：10.1021/acs.cgd.6b00119

  日期：2016.6.1

  To explore the effect of the isomeric organic ligand on the helical structure, herein, three Wells–Dawson polyoxometalates (POMs) based hybrid compounds with different helical structures by using the isomeric pyttz organic ligands, [Ag5(pyttz-I)3(H2O)2(HP2W18O62)]·H2O (1), [Ag10(pyttz-II)6(trz)2(H2O)6][HP2W18O62]2·8H2O (2), and K2[Ag7(pyttz-III)4][P2W18O62]·2H2O (3), were successfully isolated. Compound

  为了探索同分异构有机配体对螺旋结构的影响，在此，我们使用了三种同位异氰酸酯化的有机Pttz配体[Ag 5（pyttz-I）3（H ），这是基于三种具有不同螺旋结构的Wells-Dawson多金属氧酸盐（POM）2 O）2（HP 2 W 18 O 62）]·H 2 O（1），[Ag 10（pyttz-II）6（trz）2（H 2 O）6 ] [HP 2 W 18 O 62 ] 2 ·8H 2 O（2），成功分离出K 2 [Ag 7（pyttz-III）4 ] [P 2 W 18 O 62 ]·2H 2 O（3）。化合物1显示了由三种纯无机螺旋链构建并由有机分子稳定的三维（3D）无机骨架，化合物2也是如此，但3D框架由两种类型的有机-无机杂化螺旋链构建。注意化合物3显示了带有一种有机-无机杂化螺旋链的二维层。已经报道了有机配体对新化合物的螺旋结构的影响。此外，三种新化合物对MB的光分解的光催化结果表明，基于Wells-Dawson
• Construction and catalytic activities of polyoxometalate-based compound containing helical chains
  作者：Jing-Quan Sha、Xi-Ya Yang、Long-Jiang Sun、Shu-Xian Li、Ning Sheng、Ji-Shen Li

  DOI：10.1080/00958972.2016.1266619

  日期：2017.2.1

  Abstract A polyoxometalate-based, inorganic–organic hybrid compound containing a helical structure along the a axis, [Ag(pyttz)2][H2PW12O40]·2H2O (p-pyttz = 3-(pyrid-4-yl)-5-(1H-1,2,4-triazol-3-yl)-1,2,4-triazolyl), has been isolated and structurally characterized. Single-crystal X-ray diffraction analysis reveals that the new compound possesses two helical channels constructed by the left- and right-handed

  摘要 一种基于多金属氧酸盐的无机-有机杂化化合物，包含沿 a 轴的螺旋结构，[Ag(pyttz)2][H2PW12O40]·2H2O (p-pyttz = 3-(pyrid-4-yl)-5-( 1H-1,2,4-三唑-3-基)-1,2,4-三唑基)，已被分离和结构表征。单晶 X 射线衍射分析表明，新化合物具有两个分别由左手螺旋链和右手螺旋链构成的螺旋通道，它们通过共享 POM 二聚体融合在一起，形成具有 44·53 ·63} 44·53·63} 拓扑。该新化合物对阿司匹林的合成具有良好的酸催化活性，对罗丹明B染料的分解具有良好的氧化催化活性；讨论了催化反应动力学。
• 一种基于双三唑有机配体和杂多钨酸的银配合 物及其合成方法和应用
  申请人：渤海大学

  公开号：CN103483361B

  公开（公告）日：2016-01-20

  一种基于双三唑有机配体和杂多钨酸的银配合物及其合成方法和应用，分子式为：[Ag4(L1)2(H2O)2(PWVI11WVO40)]· ；[Ag4(L1)2(SiW12O40)]·5 ；[Ag4(L2)2( )2(PWVI11WVO40)]·2 ；合成方法：将AgNO3、双三唑有机配体、杂多钨酸、NH4VO3加去离子水搅拌，调pH，水热保温，得到块状棕黄色晶体，清洗晾干，得基于双三唑有机配体与杂多钨酸的银配合物。优点是：合成方法简单、合成产率高，对水溶性的有机污染物的亲和能力强、催化降解效果好，能作为光催化材料应用。
• Structure refinement and photocatalytic properties of porous POMCPs by selecting the isomerous PYTTZ
  作者：Liang Li、Jing-Wen Sun、Jing-Quan Sha、Guang-Ming Li、Peng-Fei Yan、Cheng Wang、Lian Yu

  DOI：10.1039/c4dt02960g

  日期：——

  Two POMCPs with similar building units and different motifs of tunnels were reported.

  报道了两个具有相似建筑单元但隧道结构不同的POMCPs。
• Coordination polymer-based supercapacitors with matched energy levels: enhanced capacity under visible light illumination in the presence of methanol
  作者：Hong An Tang、Miao Miao Zhang、Yun Gong、Jian Hua Lin

  DOI：10.1039/c8dt02166j

  日期：——

  A device with matched energy levels, FTO/CP 1/RuO₂ showed a much larger specific capacity than the individual components in the presence of visible light and methanol.

  在可见光和甲醇存在的情况下，具有匹配能级的装置，FTO/CP 1/RuO2，显示出比单个组分更大的比容量。