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Volumn 70, Issue 24, 2005, Pages 9735-9739

Ketene-ketenimine rearrangements in the gas phase and in polar media. 1,3-Migration intermediates and sequential transition states

Author keywords

[No Author keywords available]

Indexed keywords

ACTIVATION ENERGY; AMINES; HALOGEN COMPOUNDS; NUCLEAR MAGNETIC RESONANCE; SOLVENTS;

EID: 28144456753     PISSN: 00223263     EISSN: None     Source Type: Journal    
DOI: 10.1021/jo051389h     Document Type: Article
Times cited : (23)

References (42)
  • 1
    • 0003828015 scopus 로고
    • Wiley: Chichester
    • Ketenes: (a) Tidwell, T. T. Ketenes; Wiley: Chichester, 1995.
    • (1995) Ketenes
    • Tidwell, T.T.1
  • 4
    • 2142697756 scopus 로고
    • Thieme Verlag: Stuttgart, Germany
    • Ketenimines: Perst, H. In Houben-Weyl, Methoden der Organischen Chemie; Thieme Verlag: Stuttgart, Germany, 1993; Vol. E15/ 3, pp 2531-2710.
    • (1993) Houben-Weyl, Methoden der Organischen Chemie , vol.3 E15 , pp. 2531-2710
    • Perst, H.1
  • 12
    • 1642280495 scopus 로고    scopus 로고
    • (d) Zora, M. J. Org. Chem. 2004, 69, 1940-1947.
    • (2004) J. Org. Chem. , vol.69 , pp. 1940-1947
    • Zora, M.1
  • 26
    • 28144463350 scopus 로고    scopus 로고
    • note
    • The orientation of the acyl or imine group X-C=O or X-C= NH with respect to the cumulene function is denoted by sZ and sE. The configurations of the imine hydrogens are denoted by iE and iZ. For further details, see ref 7.
  • 30
    • 28144441210 scopus 로고    scopus 로고
    • note
    • 3 case was the difficulty in obtaining a TS, where we may have missed the minimum energy path. For the H case the limitation was the need to treat the migrating H differently from all the other migrating groups in the solvent model, where it was necessary to explicitly specify a cavity sphere on the migrating H in the transition state calculation.
  • 37
    • 28144442909 scopus 로고    scopus 로고
    • Ph.D. Thesis, The University of Queensland, Australia
    • Kvaskoff, D. Ph.D. Thesis, The University of Queensland, Australia, 2005.
    • (2005)
    • Kvaskoff, D.1
  • 39
    • 28144453319 scopus 로고    scopus 로고
    • note
    • 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.; Adamo, C.; Jaramillo, J.; Gomperts, R.; Stratmann, R. E.; Yazyev, O.; Austin, A. J.; Cammi, R.; Pomelli, C.; Ochterski, J.; 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, A. G.; Baboul, A. G.; Clifford, S.; Cioslowski, J.; Stefanov, B. B.; Liu, G.; Liashenko, A.; Piskorz, P.; Komáromi, 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. Revision B.01 ed.; Gaussian, Inc.: Pittsburgh, PA, 2003.


* 이 정보는 Elsevier사의 SCOPUS DB에서 KISTI가 분석하여 추출한 것입니다.