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N-苯基苯二甲酰亚胺和2-苯基喹噁啉晶态分子动力学行为研究
引用本文:杨清传,李一莉,唐有祺,傅亨. N-苯基苯二甲酰亚胺和2-苯基喹噁啉晶态分子动力学行为研究[J]. 物理化学学报, 1991, 7(1): 77-81. DOI: 10.3866/PKU.WHXB19910112
作者姓名:杨清传  李一莉  唐有祺  傅亨
作者单位:Institute of Physical Chemistry, Peking University; Institute of Chemistry, Academia Sinica
摘    要:本文在晶体结构分析的基础上, 对二个芳香杂环高聚物模型化合物N-苯基苯二甲酰亚胺和2-苯基喹噁啉分子的原子热振动参数进行分析, 结果表明N-苯基苯二甲酰亚胺晶态分子基本上为刚性分子, 而2-苯基喹噁啉分子的热振动应包含分子内取代苯基的内旋转运动, 其平均平方振幅为53(25) deg~2。

关 键 词:N-苯基苯二甲酰亚胺  2-苯基喹噁啉  晶体结构  晶体分子热振动分析  
收稿时间:1989-09-21
修稿时间:1990-06-02

Study on the Thermal Motion N-Phenylphthalimide and 2-Phenylquinoxaline in Solid State
Yang Qing-Chuan,Li Yi-Li,Tang You-Qi,Fu Heng. Study on the Thermal Motion N-Phenylphthalimide and 2-Phenylquinoxaline in Solid State[J]. Acta Physico-Chimica Sinica, 1991, 7(1): 77-81. DOI: 10.3866/PKU.WHXB19910112
Authors:Yang Qing-Chuan  Li Yi-Li  Tang You-Qi  Fu Heng
Affiliation:Institute of Physical Chemistry, Peking University; Institute of Chemistry, Academia Sinica
Abstract:On the basis of the data of single crystal structure analysis, the thermal motion analysis for the crystal molecules of N-phenylphthalimide (Ⅰ) and 2-phenylquinoxaline (Ⅱ) was carried out. It is shown that in solid state the molecule of compound I behaves dynamicaly as a rigid molecule and an intramolecular vibration of the substitued pheny group with <ω~2>=53(25) deg·~2 around C(8)—C(9) should be included in the molecular thermal motion of compound Ⅱ .
Keywords:N-phenylphthalimide',')  "  >N-phenylphthalimide  2-Phenylquinoxaline  Crystal Structure  Crystal molecular thermal motion
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