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Two Ag(I)-Containing Supramolecular Coordination Polymers Constructed from the Multidentate N-donor Ligand 1-((1H-1,2,4-triazol-1-yl)methyl)-3,5-bis(3-pyridyl)-1,2,4-triazole Based on Hydrogen-Bonding and π–π Interactions: Syntheses, Crystal Structures, Optical Band Gaps and Luminescent Properties
Journal of Chemical Crystallography ( IF 0.4 ) Pub Date : 2021-01-08 , DOI: 10.1007/s10870-020-00877-8
Wei-Qiu Kan , Shi-Zheng Wen , Pu-Su Zhao

Two Ag(I)-based coordination polymers, namely [Ag2(3,3′-tmbpt)(o-Hbdc)2]·H2O (1) and [Ag8(3,3′-tmbpt)4(1,2,4-Hbtc)4(H2O)] (2) (3,3′-tmbpt = 1-((1H-1,2,4-triazol-1-yl)methyl)-3,5-bis(3-pyridyl)-1,2,4-triazole, o-H2bdc = 1,2-benzenedicarboxylic acid and 1,2,4-H3btc = 1,2,4-benzenetricarboxylic acid), have been synthesized. Single-crystal X-ray diffraction analyses, elemental analyses, infrared spectra, powder X-ray diffraction analyses and thermogravimetric analyses have been carried out to characterize the structures of 1 and 2. Compound 1 shows a (3,4)-connected 2D layered structure with a Schläfli symbol of (42·6)(42·63·8). The intermolecular O–H···O hydrogen-bonding interactions extend the 2D layer into a 3D supramolecular architecture. Compound 2 exhibits a (3,3)-connected double-layered structure with a Schläfli symbol of (4·8·10)2(82·10)2. The intermolecular C–H···O hydrogen-bonding interactions link the double-layers to form a 3D supramolecular architecture. Moreover, there are intramolecular and intermolecular π–π interactions in 1 and 2, which stabilize the whole 3D supramolecular architectures. The band gaps of 1 and 2 are 3.19 and 3.09 eV, respectively, indicating the potential of 1 and 2 as semiconductive materials with wide band gaps. Moreover, 1 and 2 emit intense blue-green light, which may be potential photoactive materials. Two Ag(I)-based 3D supramolecular coordination polymers constructed from a multidentate N-donor ligand and two aromatic polycarboxylate anions via hydrogen-bonding and π–π interactions have been synthesized and characterized. The band gaps and photoluminescent properties of the compounds have been studied.

中文翻译:

由多齿 N-供体配体 1-((1H-1,2,4-triazol-1-yl)methyl)-3,5-bis(3-pyridyl)-构建的两种含 Ag(I) 超分子配位聚合物基于氢键和 π-π 相互作用的 1,2,4-三唑:合成、晶体结构、光学带隙和发光特性

两种基于 Ag(I) 的配位聚合物,即 [Ag2(3,3'-tmbpt)(o-Hbdc)2]·H2O (1) 和 [Ag8(3,3'-tmbpt)4(1,2, 4-Hbtc)4(H2O)] (2) (3,3'-tmbpt = 1-((1H-1,2,4-triazol-1-yl)methyl)-3,5-bis(3-pyridyl) )-1,2,4-三唑,o-H2bdc = 1,2-苯二甲酸和 1,2,4-H3btc = 1,2,4-苯三甲酸),已被合成。已进行单晶 X 射线衍射分析、元素分析、红外光谱、粉末 X 射线衍射分析和热重分析来表征 1 和 2 的结构。化合物 1 显示出 (3,4) 连接的二维层状Schläfli 符号为 (42·6)(42·63·8) 的结构。分子间O-H···O 氢键相互作用将2D 层扩展为3D 超分子结构。化合物 2 具有 (3,3)-连接的双层结构,Schläfli 符号为 (4·8·10)2(82·10)2。分子间C-H···O氢键相互作用将双层连接起来形成3D超分子结构。此外,在 1 和 2 中存在分子内和分子间 π-π 相互作用,稳定了整个 3D 超分子结构。1 和 2 的带隙分别为 3.19 和 3.09 eV,表明 1 和 2 作为具有宽带隙的半导体材料的潜力。此外,1和2发出强烈的蓝绿色光,这可能是潜在的光敏材料。已经合成并表征了两种基于 Ag(I) 的 3D 超分子配位聚合物,该聚合物由多齿 N 供体配体和两个芳族聚羧酸根阴离子通过氢键和 π-π 相互作用构建而成。研究了化合物的带隙和光致发光特性。
更新日期:2021-01-08
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