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Volumn 109, Issue 4, 2003, Pages 182-189

A DFT study of pyramidalized alkenes: 7-oxasesquinorbornenes and 7,7′-dioxasesquinorbornenes

Author keywords

Calculations; DFT; Pyramidalized alkenes; Sesquinorbornenes

Indexed keywords

ALKENE DERIVATIVE;

EID: 0038142825     PISSN: 1432881X     EISSN: None     Source Type: Journal    
DOI: 10.1007/s00214-002-0423-1     Document Type: Article
Times cited : (10)

References (38)
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  • 4
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    • note
    • 2.7] dodec-2(7)-ene, the numbering system used in this paper does not follow IUPAC rules
  • 6
    • 0025219864 scopus 로고
    • Paquette LA, Shen CC. Krause JA (1989) J Am Chem Soc 111:2351; Shen CC, Paquette LA (1990) J Am Chem Soc 112: 1159
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  • 23
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    • For a review on pyramidalization see Borden WT (1988) Chem Rev 89:1095
    • (1988) Chem Rev , vol.89 , pp. 1095
    • Borden, W.T.1
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    • (1997) Spartan V. 5.0
  • 26
    • 0038792077 scopus 로고    scopus 로고
    • note
    • The RHF/6-31G* results are not included in discussion, in general this basis set produces structures with φ angles smaller by 2-3° when compared to B3LYP/6-31G*
  • 32
    • 0038115101 scopus 로고
    • Paquette LA, Green KE, Gleiter R, Schafer W, Gallucci JC (1984) J Am Chem Soc 106:8232; Bartlett PD, Combs Jr. GL (1984) J Org Chem 49:625
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  • 37
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    • note
    • -1 smaller than corresponding anti- (less pyramidalized) isomer. The same result was reported previously by Brown et al. for syn-/anti-sesquinorbornenes 30 and 31 [35]


* 이 정보는 Elsevier사의 SCOPUS DB에서 KISTI가 분석하여 추출한 것입니다.