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Experimental and Theoretical Approach to Variable Chlorination-Promoted Skeletal Transformations in Fullerenes: The Case of C102
Inorganic Chemistry ( IF 4.6 ) Pub Date : 2017-11-15 00:00:00 , DOI: 10.1021/acs.inorgchem.7b02554
Olga N. Mazaleva 1 , Ilya N. Ioffe 1 , Fei Jin 2 , Shangfeng Yang 2 , Erhard Kemnitz 3 , Sergey I. Troyanov 1
Affiliation  

The first example of three alternative chlorination-promoted skeletal transformation pathways in the same fullerene cage is presented. Isolated-pentagon-rule (IPR) C102(19) undergoes both Stone–Wales rotations to give non-IPR #283794C102Cl20 and C2 losses to form nonclassical C98 and non-IPR C96. X-ray structural characterization of the transformation products and a theoretical study of their formation pathways are reported.

中文翻译:

富勒烯中可变氯化促进骨骼转化的实验和理论方法:以C 102为例

提出了在同一个富勒烯笼中的三个替代氯化促进骨骼转化途径的第一个例子。孤立的五边形规则(IPR)C 102(19)经历了Stone-Wales旋转,从而产生了非IPR #283794 C 102 Cl 20和C 2损失,从而形成了非经典C 98和非IPR C 96。报道了转化产物的X射线结构表征及其形成途径的理论研究。
更新日期:2017-11-15
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