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2012•Theoretical Chemistry AccountsRequires access

Isodesmic reaction for pK a calculations of common organic molecules

Sebastián Sastre, Rodrigo Casasnovas, Francisco Javier Jimenez Muñoz, Juan Frau

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Key concepts: Isodesmic reaction, Chemistry, Quantum chemistry, Molecule, Aqueous solution, Gas phase, Solvent, Computational chemistry

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