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Volumn 99, Issue 9, 1993, Pages 6470-6473

Adiabatic ionization energy and electron affinity of CH2Br

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[No Author keywords available]

Indexed keywords


EID: 0001147149     PISSN: 00219606     EISSN: None     Source Type: Journal    
DOI: 10.1063/1.465864     Document Type: Article
Times cited : (33)

References (27)
  • 3
    • 84951882966 scopus 로고    scopus 로고
    • The IE value of 8.34 eV is equal to the difference of the heats of formation at 0 K [formula omitted] for [formula omitted] (236.7 kcal/mol) and [formula omitted] (44.5 kcal/mol) converted from [formula omitted] [formula omitted] and [formula omitted] [formula omitted] obtained from Refs. 1 and 2, respectively. The conversion is based on vibrational frequencies for [formula omitted] and [formula omitted] calculated at the [formula omitted] level scaled by 0.89
  • 4
    • 84951894267 scopus 로고    scopus 로고
    • In Ref. 2, a value of 224 kcal/mol is mistakenly cited for [formula omitted] from Ref. 1. Based on this value, a value of 7.9 eV was calculated and recommended as the adiabatic [formula omitted] in Ref. 2
  • 23
    • 84934460107 scopus 로고
    • Note that there is a misprint with regards to the Br basis: the third coefficient should be 0.008 745 7, instead of 0.087 457 (Curtiss, private communication)
    • (1990) J. Comput. Chem , vol.11 , pp. 1206
    • Binning, J.R.C.1    Curtiss, L.A.2
  • 26
    • 84951881249 scopus 로고    scopus 로고
    • (unpublished results) A weak ion-pair process, [formula omitted] has also been observed recently in our laboratory.
    • Ma, Z.-X.1    Liao, C.-L.2    Ng, C.Y.3


* 이 정보는 Elsevier사의 SCOPUS DB에서 KISTI가 분석하여 추출한 것입니다.