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Volumn 133, Issue 35, 2011, Pages 13824-13827

Competition between reaction and intramolecular energy redistribution in solution: Observation and nature of nonstatistical dynamics in the ozonolysis of vinyl ethers

Author keywords

[No Author keywords available]

Indexed keywords

ALKYL GROUPS; ENERGY LOSS; INTRAMOLECULAR ENERGY; INTRAMOLECULAR VIBRATIONAL ENERGY REDISTRIBUTIONS; NONSTATISTICAL DYNAMICS; OZONOLYSIS; PRODUCT RATIOS; RRKM THEORY; STATISTICAL MODELS; STATISTICAL RATE THEORY; VINYL ETHERS;

EID: 80052333518     PISSN: 00027863     EISSN: 15205126     Source Type: Journal    
DOI: 10.1021/ja2043497     Document Type: Article
Times cited : (52)

References (40)
  • 2
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    • 70350639423 scopus 로고    scopus 로고
    • Recent work (see:) has proposed a "canonical competitive nonstatistical model" (CCNM) to predict product branching ratios after dynamical bottlenecks of the type seen in the current reaction. The CCNM model divides the branching into "indirect" and "direct" components, the former being predicted using TST and the latter using phase-space theory. The large barriers for the reaction of the primary ozonide in the present work cause the CCNM model to allocate 100% of the reaction to the indirect component, so the CCNM model fails qualitatively to the extent that TST itself fails
    • Recent work (see: Zheng, J.; Papajak, E.; Truhlar, D. G. J. Am. Chem. Soc. 2009, 131, 15754) has proposed a "canonical competitive nonstatistical model" (CCNM) to predict product branching ratios after dynamical bottlenecks of the type seen in the current reaction. The CCNM model divides the branching into "indirect" and "direct" components, the former being predicted using TST and the latter using phase-space theory. The large barriers for the reaction of the primary ozonide in the present work cause the CCNM model to allocate 100% of the reaction to the indirect component, so the CCNM model fails qualitatively to the extent that TST itself fails
    • (2009) J. Am. Chem. Soc. , vol.131 , pp. 15754
    • Zheng, J.1    Papajak, E.2    Truhlar, D.G.3


* 이 정보는 Elsevier사의 SCOPUS DB에서 KISTI가 분석하여 추출한 것입니다.