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Volumn 132, Issue 10, 2010, Pages 3304-3311

Probing substituent effects in aryl-aryl interactions using stereoselective diels-alder cycloadditions

Author keywords

[No Author keywords available]

Indexed keywords

DIELS-ALDER CYCLOADDITIONS; DISPERSION EFFECT; ELECTRON DONORS; ELECTRON-DONATING; GASPHASE; MODEL SYSTEM; PRODUCT DISTRIBUTIONS; SANDWICH COMPLEXES; STACKING INTERACTION; STEREO-SELECTIVE; SUBSTITUENT CONSTANTS; SUBSTITUENT EFFECT; SUBSTITUTED BENZENES; THROUGH-SPACE INTERACTION; TRANSITION STATE;

EID: 77949389582     PISSN: 00027863     EISSN: 15205126     Source Type: Journal    
DOI: 10.1021/ja903653j     Document Type: Article
Times cited : (171)

References (102)
  • 22
    • 64849105608 scopus 로고    scopus 로고
    • Lipkowitz, K. B., Cundari, T. R., Eds.;;Wiley-VCH; New York
    • Sherrill, C. D. In Reviews in Computational Chemistry; Lipkowitz, K. B., Cundari, T. R., Eds.;;Wiley-VCH; New York, 2009; Vol.26, pp 1-38.
    • (2009) Reviews in Computational Chemistry , vol.26 , pp. 1-38
    • Sherrill, C.D.1
  • 38
    • 77949418991 scopus 로고    scopus 로고
    • This model is also often referred to as the Hunter-Sanders rules
    • This model is also often referred to as the Hunter-Sanders rules.
  • 58
    • 73349109506 scopus 로고    scopus 로고
    • Although some authors dismiss OMe as a π-donor in this context on the basis of computed electrostatic potential plots, this is actually due to false assumptions regarding substituent effects on arene ESPs
    • Although some authors dismiss OMe as a π-donor in this context on the basis of computed electrostatic potential plots, this is actually due to false assumptions regarding substituent effects on arene ESPs. See: Wheeler, S. E.; Houk, K. N. J. Chem. Theory Comput. 2009, 5, 2301-2312.
    • (2009) J. Chem. Theory Comput. , vol.5 , pp. 2301-2312
    • Wheeler, S.E.1    Houk, K.N.2
  • 94
    • 77949363838 scopus 로고    scopus 로고
    • Estimated CCSD(T)/aug-cc-pVTZ = CCSD(T)/AVDZ′ + (MP2/augcc-pVTZ - MP2/AVDZ′)
    • Estimated CCSD(T)/aug-cc-pVTZ = CCSD(T)/AVDZ′ + (MP2/augcc-pVTZ - MP2/AVDZ′).
  • 102
    • 77949403907 scopus 로고    scopus 로고
    • Université de Sherbrooke; Sherbrooke, Canada
    • Legault, C. Y. CYLview, 1.0b; Université de Sherbrooke; Sherbrooke, Canada, 2009; http://www.cylview.org.
    • (2009)
    • Legault, C.Y.1


* 이 정보는 Elsevier사의 SCOPUS DB에서 KISTI가 분석하여 추출한 것입니다.