AN INVESTIGATION OF THE ELECTRONIC-STRUCTURE OF THE ANTITUMOR DRUG ELLIPTICINE AND ITS DERIVATIVES .2. SPECTROSCOPIC INDO CI STUDY

被引:5
作者
DANTAS, SO
GALVAO, DS
机构
[1] Institute de Física Gleb Wataghin, UNICAMP, CP 6165
来源
JOURNAL OF MOLECULAR STRUCTURE-THEOCHEM | 1992年 / 257卷 / 3-4期
基金
巴西圣保罗研究基金会;
关键词
D O I
10.1016/0166-1280(92)85054-O
中图分类号
O64 [物理化学(理论化学)、化学物理学];
学科分类号
070304 ; 081704 ;
摘要
Ellipticine and its derivatives are molecules that show antitumour and cytotoxic activity, with a multimodal mechanism of action. In this paper we report a spectroscopic intermediate neglect of differential overlap with configuration interaction study of ellipticine and some of its derivatives, in the neutral and charged states. A mechanism that could improve the antitumoural and cytotoxic activity of these compounds is proposed.
引用
收藏
页码:437 / 449
页数:13
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