作者: Yu. V. Minenkov , O. V. Lefedova , I. V. Smirnova , M. P. Nemtseva
DOI: 10.1134/S003602441205024X
关键词:
摘要: Quantum-chemical calculations of the thermodynamic characteristics hydrogenation nitrobenzoic acid isomers and nitrophenol in gas phase also aqueous alcoholic media were performed. Correlation dependences between calculated ΔrG298○ values rate constants for reaction various obtained.