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Volumn 41, Issue 19, 2002, Pages 3628-3631

Protonated benzene: IR spectrum and structure of C6H7+

Author keywords

Arenium ions; Aromatic substitution; Carbocations; IR spectroscopy; Reactive intermediates

Indexed keywords

GEOMETRY; HYDROCARBONS; INFRARED SPECTROSCOPY; IONS;

EID: 0037020425     PISSN: 14337851     EISSN: None     Source Type: Journal    
DOI: 10.1002/1521-3773(20021004)41:19<3628::AID-ANIE3628>3.0.CO;2-1     Document Type: Article
Times cited : (172)

References (32)
  • 24
    • 0001351762 scopus 로고
    • H. H. Perkampus, E. Baumgarten, Angew. Chem. 1964, 76, 965; Angew. Chem. Int. Ed. Engl. 1964, 3, 776.
    • (1964) Angew. Chem. Int. Ed. Engl. , vol.3 , pp. 776
  • 29
    • 2142781349 scopus 로고    scopus 로고
    • note
    • Ab initio calculations were carried out at the MP2/6-311G(2df,2pd) level. All coordinates were relaxed during the search for stationary points. Energies were fully counterpoise-corrected for basis set superposition error and anharmonic zero-point energies. Harmonic frequencies were scaled by a factor of 0.94260. Frequency calculations for the dimers were performed at the MP2/6-31G* level.
  • 32
    • 2142777627 scopus 로고    scopus 로고
    • note
    • +·Ar, respectively.


* 이 정보는 Elsevier사의 SCOPUS DB에서 KISTI가 분석하여 추출한 것입니다.