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Volumn 5, Issue 1, 2014, Pages 21-31

Do spin state and spin density affect hydrogen atom transfer reactivity?

Author keywords

[No Author keywords available]

Indexed keywords

CHEMICAL AND BIOLOGICALS; COMPUTATIONAL STUDIES; ELECTRONIC SPIN STATE; HYDROGEN ATOM TRANSFERS (HAT); HYDROGEN-ATOM TRANSFER; ORGANIC CHEMISTRY COURSE; PROTON-COUPLED ELECTRON TRANSFER; UNDERLYING FACTORS;

EID: 84888589591     PISSN: 20416520     EISSN: 20416539     Source Type: Journal    
DOI: 10.1039/c3sc52664j     Document Type: Review
Times cited : (119)

References (99)
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    • K. U. Ingold and G. A. Russell, in Free Radicals, ed., J. K. Kochi, Wiley, New York, 1973, pp. 283-293, ch. 7
    • (1973) Free Radicals
    • Ingold, K.U.1    Russell, G.A.2
  • 46
    • 84888634532 scopus 로고
    • in, ed. J. K. Kochi, Wiley, New York, p. 69, ch. 2
    • K. U. Ingold and G. A. Russell, in Free Radicals, ed., J. K. Kochi, Wiley, New York, 1973, p. 69, ch. 2
    • (1973) Free Radicals
    • Ingold, K.U.1    Russell, G.A.2
  • 47
    • 18844424175 scopus 로고
    • ‡/∂ΔG°). 22 This conclusion may not apply to gas-phase ion molecule reactions, where the long-range attraction of the ion and molecule and lack of thermal equilibration of the reactant complex with solvent lead to different kinetic properties. Cf.
    • M. G. Evans M. Polanyi Trans. Faraday Soc. 1938 34 11 24
    • (1938) Trans. Faraday Soc. , vol.34 , pp. 11-24
    • Evans, M.G.1    Polanyi, M.2
  • 49
    • 84888604391 scopus 로고    scopus 로고
    • Meta-analysis, in Wikipedia
    • Meta-analysis, in Wikipedia, http://en.wikipedia.org/wiki/Meta-analysis
  • 52
    • 48749089759 scopus 로고    scopus 로고
    • Most of these studies do not discuss the computed spin densities at the abstracting oxygen, so it is possible that the singlet state could be an open-shell singlet with significant unpaired spin density at oxygen
    • H. Hirao L. Que W. Nam S. Shaik Chem.-Eur. J. 2008 14 1740 1756
    • (2008) Chem.-Eur. J. , vol.14 , pp. 1740-1756
    • Hirao, H.1    Que, L.2    Nam, W.3    Shaik, S.4
  • 86
    • 36849008128 scopus 로고    scopus 로고
    • This would make eqn (6) HAT in the forward direction but not in the reverse direction
    • M.-H. V. Huynh T. J. Meyer Chem. Rev. 2007 107 5004 5064
    • (2007) Chem. Rev. , vol.107 , pp. 5004-5064
    • Huynh, M.-H.V.1    Meyer, T.J.2


* 이 정보는 Elsevier사의 SCOPUS DB에서 KISTI가 분석하여 추출한 것입니다.