Protonation Thermochemistry of Gaseous 2,2'-, 4,4'- and 2,4'-Bipyridines and 1,10-phenanthroline

Croatica Chemica Acta

Riou, Delphine¹  Bouchoux, Guy¹ 

[1] Laboratoire de Chimie Moléculaire, Ecole Polytechnique, UMR CNRS 9168, F-91128 Palaiseau cedex, France and Université Paris-Sud XI, F-91140 Orsay cedex

关键词: G4 computation;    gas-phase basicity;    proton affinity;    heat of formation;    bipyridine;    phenanthroline;   

DOI  :  

学科分类：化学（综合）

来源: Croatica Chemica Acta

【 摘 要 】

Quantum chemical composite methods G3MP2B3, G3B3, G4MP2 and G4 have been used to calculate enthalpies of formation and gas phase basicities of the title compounds. Comparison of the results with the available experimental heats of...

【 授权许可】

Unknown