摘要
用分子力学方法对一系列标题化合物进行了研究,对它们的构象和能量的分子力学计算结果表明,在这类配合物中,五员鳌环比六员鳌环稳定,随冠醚环大小和分子内张力的变化。
The energy and conformations of a series of homologous thioether Crown-Copper(Ⅱ) complexes have been Calculated with MMPM Program of molecular mechanics method.The experimental facts show that the strain energy,thermodynamic stabilities and dynamic stabilities of the titled molecules vary regularly with the variation of their ring size.
出处
《山东师范大学学报(自然科学版)》
CAS
1997年第2期170-173,共4页
Journal of Shandong Normal University(Natural Science)