摘要
应用氢氧滴定仪对钌掺杂聚吡咯络合物（ＰＰＲＵＣ）的实际吸附小分子Ｈ２和Ｏ２的能力进行了测试，同时应用量子化学的方法（ＣＮＤＯ／２程序）对小分子Ｈ２和Ｏ２一种分子的单个、多个吸附以及Ｈ２和Ｏ２的不同组合的吸附进行了理论计算；对以上的各种情况在ＰＰＲＵＣ上的不同位置的吸附也进行了理论计算。测试表明在同一温度下ＰＰＲＵＣ对Ｏ２的吸附量是对Ｈ２的吸附量的９～１３倍。理论计算表明，顺式ＰＰＲＵＣ和反式ＰＰＲＵＣ对Ｏ２的吸附都很稳定，只有反式ＰＰＲＵＣ对Ｈ２有稳定的吸附。理论计算和实际吸附测试的结果得到了很好的印证。
The capability of a polypyrrole complex doped by Ru adsorpting small molecular H 2 and O 2 were determined by oxyhydrogen titration instrument . Location and mate of absorpting small molecular H 2 and O 2 were calculated by CNDO/2 method theoretically. In same temperature, the determining result indicated that the adsorption amount for O 2 is nine —thirteen times of amount for H 2. The result of theory calculation indicated that Z -PPRUC and E -PPRUC adsorpted O 2 both stakly, E -PPRUC only adsorpted stably for H 2.The result of theory calculation and practiccal measurement was confirmed.
出处
《石油化工高等学校学报》
EI
CAS
1998年第4期25-27,50,共4页
Journal of Petrochemical Universities
基金
辽宁省自然科学基金
关键词
钌络合物
掺杂
聚吡咯
化学吸附
催化剂
活性
Complex of Ru
Doped polypyrrole
Chemical adsorption
CNDO/2 method
