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Proton affinity and gas-phase basicity of hydroxyquinol: A computational study

โœ Scribed by Mayhan, Collin M.; Kumari, Harshita; McClure, Elizabeth M.; Liebman, Joel F.; Deakyne, Carol A.


Book ID
121424208
Publisher
Elsevier Science
Year
2014
Tongue
English
Weight
579 KB
Volume
73
Category
Article
ISSN
0021-9614

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