会议专题

Template-Designed Synthesis of Open-Framework Zinc Phosphites with Eztra-Large 24-Ring Channels

The rational selection of the templating agents or structure-directing agents (SDAs) is important for the designed synthesis of open-framework materials with specific channel structures. By utilizing organic amines that are predicted by computer simulations using Materials Studio software and Cerius package as the templates or SDAs, such as cyclohexanamine (CHA), cyclopentylamine (CPA), and n-propylamine, three new open-framework zinc phosphites, including (C6H14N)2Zn3(HPO3)4 (ZnHPO-CJ2), (C5H12N)2Zn3(HPO3)4 (ZnHPO-CJ3), and (C3H10N)2Zn3(HPO3)4 (ZnHPO-CJ4), have been hydrothermally prepared with desired extra-large 24-ring channels analogous to (C4NH12)2Zn3(HPO3)4 (ZnHPO-CJ1). Their structures are characterized by single-crystal and powder X-ray diffraction, ICP, IR, and TG analyses. These organic amines predicted based on non-bonding interactions of host-guest show good matching in the space and charge density with the host inorganic framework. As with ZnHPO-CJ1 and other known extra-large micropore materials with high framework charge density, the 24-rings of these compounds are assembled around multiple small amines, exemplifying the cooperative templating mechanism of multiple small organic cations in the formation of extra-large micropore open-framework materials. This work demonstrates a useful strategy toward the template-designed synthesis of microporous materials with extra-large micropores.

Jiyang Li Li Li Jihong Yu Ruren Xu

State Key Laboratory of Inorganic Synthesis and Preparative Chemistry, College of Chemistry, Jilin University, Changchun 130012, P.R.China

国际会议

第四届国际分子模拟与信息技术应用学术会议(The 4th International Conference of Molecular Simulations and Applied Informatics Technologies)

广州

英文

597-608

2008-11-01(万方平台首次上网日期,不代表论文的发表时间)