作者: Igor Novak , Branka Kovač
DOI: 10.1021/JO040154N
关键词: X-ray photoelectron spectroscopy 、 Ionization energy 、 Electronic structure 、 Lone pair 、 Analytical chemistry 、 Substituent 、 Molecule 、 Chemistry 、 Quinoline 、 Physical chemistry 、 Spectrophotometry
摘要: The molecular and electronic structure of eight substituted quinolines has been investigated by HeI/HeII photoelectron spectroscopy, Green's function calculations, comparison with the spectra related compounds. correlation between nitrogen lone pair ionization energies basicity in 18 is discussed. influence different substituents quantified via scheme that based on experimental energy shifts. relationships energies, pK(a) values, medicinal activity are also