Alkali Metal Cation versus Proton and Methyl Cation Affinities: Structure and Bonding Mechanism
We have analyzed the structure and bonding of gas‐phase Cl−X and [HCl−X]+ complexes for X+= H+, CH3 +, Li+, and Na+, using relativistic density functional theory (DFT). We wish to establish a quantitative trend in affinities of the anionic and neutral Lewis bases Cl− and HCl for the various cations....
Main Authors: | , , |
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Format: | Online |
Language: | English |
Published: |
John Wiley and Sons Inc.
2016
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Online Access: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC4984409/ |