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On the relative acidities of organic compounds: Electronic and geometric relaxation energies
Uppsala University.
1999 (English)In: JOURNAL OF THE AMERICAN CHEMICAL SOCIETY, Vol. 121, no 48, 11217-11222 p.Other (Other scientific)
Abstract [en]

The energy for deprotonation of a molecule in the gas phase may be divided into an initial-state electrostatic part and a relaxation part. The electrostatic part is dominating in determining the relative acidities of organic compounds, but the relaxation

Place, publisher, year, pages
AMER CHEMICAL SOC , 1999. Vol. 121, no 48, 11217-11222 p.
Keyword [en]
CARBOXYLIC-ACIDS; GAS-PHASE; RESONANCE STABILIZATION; STRONGER ACIDS; BASIS SET; ALCOHOLS; DELOCALIZATION; ENOLS; BOND; INDUCTION
Identifiers
URN: urn:nbn:se:uu:diva-84817OAI: oai:DiVA.org:uu-84817DiVA: diva2:112725
Note
Addresses: Bokman F, Univ Uppsala, Dept Organ Chem, POB 531, SE-75121 Uppsala, Sweden. Univ Uppsala, Dept Organ Chem, SE-75121 Uppsala, Sweden.Available from: 2008-10-17 Created: 2008-10-17

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