ICCAS OpenIR
Photoelectron spectroscopic (PES) and theoretical studies on two alkyl nitrites that affect the eco-enviromnent
Sun, Z; Zheng, SJ; Wang, DX
2001
Source PublicationACTA CHIMICA SINICA
ISSN0567-7351
Volume59Issue:11Pages:2031-2033
AbstractThe photoelectron spectroscopy (PES) of iso - propyl nitrite (CH3)(2)CHONO and tert - butyl nitrite (CH3)(3)CONO are reported. By combining the PES measurements with theoretical calculations on the compounds, we conclude that the first vertical ionization potential for the two compounds are 10.37 and 10.12 eV, respectively. An unmistakable substituent effect on the ionization potential was observed. Comparison of different calculations shows that the outer valence Green's function (OVGF) method gives quite good results in ionization potentials calculations. It is also pointed out that alkyl nitrites are good source for obtaining ROcircle radicals based on the experimental and theoretical analysis.
KeywordAlkyl Nitrite Photoelectron Spectroscopy Ab Initio Ionization Potential Alkyloxy Radicals
Indexed BySCI
Language英语
WOS IDWOS:000173115200035
PublisherSCIENCE CHINA PRESS
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Document Type期刊论文
Identifierhttp://ir.iccas.ac.cn/handle/121111/77016
Collection中国科学院化学研究所
Corresponding AuthorSun, Z
Affiliation1.Chinese Acad Sci, Inst Chem, State Key Lab Struct Chem Unstable & Stable Speci, Beijing 100080, Peoples R China
2.Hebei Teachers Univ, Dept Chem, Shijiazhuang 050091, Peoples R China
Recommended Citation
GB/T 7714
Sun, Z,Zheng, SJ,Wang, DX. Photoelectron spectroscopic (PES) and theoretical studies on two alkyl nitrites that affect the eco-enviromnent[J]. ACTA CHIMICA SINICA,2001,59(11):2031-2033.
APA Sun, Z,Zheng, SJ,&Wang, DX.(2001).Photoelectron spectroscopic (PES) and theoretical studies on two alkyl nitrites that affect the eco-enviromnent.ACTA CHIMICA SINICA,59(11),2031-2033.
MLA Sun, Z,et al."Photoelectron spectroscopic (PES) and theoretical studies on two alkyl nitrites that affect the eco-enviromnent".ACTA CHIMICA SINICA 59.11(2001):2031-2033.
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