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Volumn 73, Issue 16, 2008, Pages 6073-6078

Bicorannulenyl: Stereochemistry of a C40H18 biaryl composed of two chiral bowls

Author keywords

[No Author keywords available]

Indexed keywords

CHEMISTRY; DISCRETE FOURIER TRANSFORMS; MINE FLOODING; NUCLEAR MAGNETIC RESONANCE; NUCLEAR MAGNETIC RESONANCE SPECTROSCOPY; PROBABILITY DENSITY FUNCTION; SIGNAL PROCESSING; STEREOCHEMISTRY; SULFUR COMPOUNDS;

EID: 50149089990     PISSN: 00223263     EISSN: None     Source Type: Journal    
DOI: 10.1021/jo800359z     Document Type: Article
Times cited : (45)

References (51)
  • 1
    • 84891008336 scopus 로고    scopus 로고
    • For recent reviews, see:, Haley, M. M, Tykwinski, R. R, Eds, Wiley-VCH: Weinheim, Germany
    • For recent reviews, see: Sygula, A.; Rabideau, P. W. In Carbon-Rich Compounds: From Molecules to Materials; Haley, M. M., Tykwinski, R. R., Eds.; Wiley-VCH: Weinheim, Germany, 2006; pp 529-565.
    • (2006) Carbon-Rich Compounds: From Molecules to Materials , pp. 529-565
    • Sygula, A.1    Rabideau, P.W.2
  • 27
    • 20644459524 scopus 로고    scopus 로고
    • First discovered in 2,2′-dinitro-6,6′-dicarboxylic acid-biphenyl: Christie, G. H.; Kenner, J. H. J. Chem. Soc. 1922, 121, 614.
    • First discovered in 2,2′-dinitro-6,6′-dicarboxylic acid-biphenyl: Christie, G. H.; Kenner, J. H. J. Chem. Soc. 1922, 121, 614.
  • 28
    • 50149106742 scopus 로고    scopus 로고
    • A brief attempt to resolve the stereodynamics of neutral bicorannulenyl and to study its reduction pattern appears in: Shabtai, E. From cyclophanes to fullerenes: Three dimensional carbon rich anions. Ph.D. dissertation, The Hebrew University of Jerusalem, Israel, 1999
    • A brief attempt to resolve the stereodynamics of neutral bicorannulenyl and to study its reduction pattern appears in: Shabtai, E. From cyclophanes to fullerenes: Three dimensional carbon rich anions. Ph.D. dissertation, The Hebrew University of Jerusalem, Israel, 1999.
  • 31
    • 50149086292 scopus 로고    scopus 로고
    • See Supporting Information for more details
    • See Supporting Information for more details.
  • 32
    • 50149091932 scopus 로고    scopus 로고
    • An alternative definition of the torsion angle in 2 designates ω as the angle between the calculated mean planes of the two bowls
    • An alternative definition of the torsion angle in 2 designates ω as the angle between the calculated mean planes of the two bowls.
  • 34
    • 50149103529 scopus 로고    scopus 로고
    • 180 provide reasonable lower limit estimations for the respective barriers.
    • 180 provide reasonable lower limit estimations for the respective barriers.
  • 35
    • 50149091279 scopus 로고    scopus 로고
    • Gaussian '03, Revision B.05; Frisch, M. J, Trucks, G. W, Schlegel, H. B, Scuseria, G. E, Robb, M. A, Cheeseman, J. R, Montgomery, J. A, Jr, Vreven, T, Kudin, K. N, Burant, J. C, Millam, J. M, Iyengar, S. S, Tomasi, J, Barone, V, Mennucci, B, Cossi, M, Scalmani, G, Rega, N, Petersson, G. A, Nakatsuji, H, Hada, M, Ehara, M, Toyota, K, Fukuda, R, Hasegawa, J, Ishida, M, Nakajima, T, Honda, Y, Kitao, O, Nakai, H, Klene, M, Li, X, Knox, J. E, Hratchian, H. P, Cross, J. B, Bakken, V, Adamo, C, Jaramillo, J, Gomperts, R, Stratmann, R. E, Yazyev, O, Austin, A. J, Cammi, R, Pomelli, C, Ochterski, J. W, Ayala, P. Y, Morokuma, K, Voth, G. A, Salvador, P, Dannenberg, J. J, Zakrzewski, V. G, Dapprich, S, Daniels, A. D, Strain, M. C, Farkas, O, Malick, D. K, Rabuck, A. D, Raghavachari, K, Foresman, J. B, Ortiz, J. V, Cui, Q, Baboul, A. G, Clifford, S, Cioslowski, J, Stefanov, B. B, Liu, G, Liashenko, A, Piskorz, P, Komaromi
    • Gaussian '03, Revision B.05; Frisch, M. J.; Trucks, G. W.; Schlegel, H. B.; Scuseria, G. E.; Robb, M. A.; Cheeseman, J. R.; Montgomery, J. A., Jr.; Vreven, T.; Kudin, K. N.; Burant, J. C.; Millam, J. M.; Iyengar, S. S.; Tomasi, J.; Barone, V.; Mennucci, B.; Cossi, M.; Scalmani, G.; Rega, N.; Petersson, G. A.; Nakatsuji, H.; Hada, M.; Ehara, M.; Toyota, K.; Fukuda, R.; Hasegawa, J.; Ishida, M.; Nakajima, T.; Honda, Y.; Kitao, O.; Nakai, H.; Klene, M.; Li, X.; Knox, J. E.; Hratchian, H. P.; Cross, J. B.; Bakken, V., Adamo, C.; Jaramillo, J.; Gomperts, R.; Stratmann, R. E.; Yazyev, O.; Austin, A. J.; Cammi, R.; Pomelli, C.; Ochterski, J. W.; Ayala, P. Y.; Morokuma, K.; Voth, G. A.; Salvador, P.; Dannenberg, J. J.; Zakrzewski, V. G.; Dapprich, S.; Daniels, A. D.; Strain, M. C.; Farkas, O.; Malick, D. K.; Rabuck, A. D.; Raghavachari, K.; Foresman, J. B.; Ortiz, J. V.; Cui, Q.; Baboul, A. G.; Clifford, S.; Cioslowski, J.; Stefanov, B. B.; Liu, G.; Liashenko, A.; Piskorz, P.; Komaromi, I.; Martin, R. L.; Fox, D. J.; Keith, T.; Al-Laham, M. A.; Peng, C. Y.; Nanayakkara, A.; Challacombe, M. ; Gill, P. M. W.; Johnson, B.; Chen, W.; Wong, M. W.; Gonzalez, C.; Pople, J. A. Gaussian, Inc.: Wallingford, CT, 2003.
  • 36
    • 50149122580 scopus 로고    scopus 로고
    • The calculated difference in energy between S.PP and S.MM is too small to assign them to (a) or (b) unequivocally. The implications of this vagueness on the actual stereochemical picture are negligible.
    • The calculated difference in energy between S.PP and S.MM is too small to assign them to (a) or (b) unequivocally. The implications of this vagueness on the actual stereochemical picture are negligible.
  • 40
    • 50149106964 scopus 로고    scopus 로고
    • The bowl depth is defined as the average distance between the 10 rim carbons and the plane defined by the central pentagon
    • The bowl depth is defined as the average distance between the 10 rim carbons and the plane defined by the central pentagon.
  • 46
    • 50149102158 scopus 로고    scopus 로고
    • Ph.D. dissertation, Boston College, Chestnut Hill, MA
    • Cheng, P.-C. Corannulene: Novel synthesis and reactions. Ph.D. dissertation, Boston College, Chestnut Hill, MA, 1996.
    • (1996) Novel synthesis and reactions
    • Cheng, P.-C.C.1


* 이 정보는 Elsevier사의 SCOPUS DB에서 KISTI가 분석하여 추출한 것입니다.