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Halogen bonds and metal bonds involving superalkalies M2OCN/M2NCO (M?=?Li,Na) complexes |
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| Authors: | Zheng Baishu Zhou Fengxiang Liu Yi Wang Zhaoxu Liu Yuan Ding Xunlei |
| Institution: | 1.Key Laboratory of Theoretical Organic Chemistry and Functional Molecular, Ministry of Education, Hunan University of Science and Technology, Xiangtan, 411201, China ;2.Laboratory of Controllable Preparation and Functional Application of Fine Polymers, School of Chemistry and Chemical Engineering, Hunan University of Science and Technology, Xiangtan, 411201, China ;3.Department of Mathematics and Physics, North China Electric Power University, Beinong Road 2, Changping, 102206, Beijing, People’s Republic of China ; |
| Abstract: | Structural Chemistry - A new type of halogen bond formed by supermetals or superalkalies with dihalogen molecules was analyzed by means of ab initio at the MP2/aug-cc-pVTZ level. The results reveal... |
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