First local minimum of the formic acid dimer exhibits simultaneously red-shifted O–H⋯O and improper blue-shifted C–H⋯O hydrogen bonds
Author:
Publisher
Royal Society of Chemistry (RSC)
Subject
Physical and Theoretical Chemistry,General Physics and Astronomy
Link
http://pubs.rsc.org/en/content/articlepdf/2004/CP/B314148A
Reference21 articles.
1. Potential energy and free energy surfaces of the formic acid dimer: Correlated ab initio calculations and molecular dynamics simulationsElectronic supplementary information (ESI) available: Optimised geometries of the structures in Tables 1 and 2. See http://www.rsc.org/suppdata/cp/b1/b110872g/
2. F. Madeja , M.Havenith, K.Nauta, R. E.Miller, J.Chocholoušová and P.Hobza, J. Chem. Phys., submitted
3. Dimerization of Formic Acid-An Example of a “Noncovalent” Reaction Mechanism
4. Blue-Shifting Hydrogen Bonds
5. Intermolecular interactions and anesthesia: Infrared spectroscopic studies
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