Article ID Journal Published Year Pages File Type
5381752 Chemical Physics Letters 2013 6 Pages PDF
Abstract

- The (HCOOH, CO2) pair is the most stable, and the (HCHO, CO2) pair is the least stable.
- The strength of complexes is mainly contributed by the O(N)⋯C acid-base interaction.
- The stability of (HCOOH, CO2) pair is mainly determined by the O-H⋯O hydrogen bond.
- The C-H⋯O blue shifting hydrogen bond is revealed in some complexes investigated.
- The C-H⋯O hydrogen bond is not found in the (CH3OCH3, CO2) and (CH3NH2, CO2) pairs.
Related Topics
Physical Sciences and Engineering Chemistry Physical and Theoretical Chemistry
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