摘要
多氯取代对二苯并呋喃结构和电荷分布影响的量子化学研究苏忠民,盛连喜,赵宝忠(东北师范大学化学系,长春130024)王东仁,李金昶(东北师范大学测试中心,长春,130024)关键词:多氯代二苯并呋喃,电荷分布,量子化学计算本文采用量子化学方法,以多氯二...
In this paper,the structures of polychlorinated dibenzofurans are firstly optmized in fullfree-degree by using the quantum chemistry MNDO method. The influence of chlorinationon the regularities of structures and charge distribution of dibenzofuran are studied. Somesignificant information are provided for dcaling with poisons in envirenmental chemistry.
出处
《化学研究与应用》
CAS
CSCD
1995年第2期166-169,共4页
Chemical Research and Application