| Abstract
| - A quantitative structure−property relationship (QSPR) study of the gas-phase lithium cation basicity of adiverse set of 205 compounds provided a general six-parameter QSPR model (R2 = 0.801; R2cv = 0.785; F= 133.11; s2 = 8.78) using the CODESSA PRO program. Theoretical molecular descriptors, such as theminimum net atomic charge, highest occupied molecular orbital energy, total point-charge component of themolecular dipole, etc., logically explain the reaction equilibrium and electrostatic interaction between a lithiumcation and a base.
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