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Theoretical study of the interaction mechanism of single-electron halogen bond complexes H_3C…Br-Y(Y=H,CN,NC,CCH,C_2H_3) |
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| Authors: | LI ZhiFeng SHI XiaoNing TANG HuiAn & ZHANG JunYan College of Life Science Chemistry Tianshui Normal University Tianshui China Lanzhou Institute of Chemical Physics Chinese Academy of Sciences Lanzhou |
| Institution: | LI ZhiFeng1,SHI XiaoNing1,TANG HuiAn1 & ZHANG JunYan2 1College of Life Science , Chemistry,Tianshui Normal University,Tianshui 741001,China,2Lanzhou Institute of Chemical Physics,Chinese Academy of Sciences,Lanzhou 730000 |
| Abstract: | |
| Keywords: | single-electron halogen bond single-electron hydrogen bond single-electron lithium bond MP2 DFT NBO AIM |
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