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Volumn 118, Issue 18, 1996, Pages 4299-4313

Molecular mechanics predictions and experimental testing of asymmetric palladium-catalyzed allylation reactions using new chiral phenanthroline ligands

Author keywords

[No Author keywords available]

Indexed keywords

PALLADIUM COMPLEX; PHENANTHROLINE DERIVATIVE;

EID: 0343136162     PISSN: 00027863     EISSN: None     Source Type: Journal    
DOI: 10.1021/ja950860t     Document Type: Article
Times cited : (128)

References (61)
  • 1
    • 84889530307 scopus 로고    scopus 로고
    • University of Notre Dame
    • (a) University of Notre Dame.
  • 2
    • 84889510775 scopus 로고    scopus 로고
    • Rayal Danish School of Pharmacy
    • (b) Rayal Danish School of Pharmacy.
  • 3
    • 84889533777 scopus 로고    scopus 로고
    • Royal Institute of Technology
    • (c) Royal Institute of Technology.
  • 4
    • 84889525451 scopus 로고    scopus 로고
    • Universita di Napoli
    • (d) Universita di Napoli.
  • 5
    • 84889520134 scopus 로고    scopus 로고
    • Università del Molise
    • (e) Università del Molise.
  • 6
    • 84942799202 scopus 로고
    • Wukinson, G., Stone F. G. A., Abel, E. W., Eds.; Pergamon: Oxford
    • (a) Kagan, H. B. In Comprehensive Organometallic Chemistry; Wukinson, G., Stone F. G. A., Abel, E. W., Eds.; Pergamon: Oxford, 1982; Vol. 8, pp 463-498.
    • (1982) Comprehensive Organometallic Chemistry , vol.8 , pp. 463-498
    • Kagan, H.B.1
  • 14
    • 0004151408 scopus 로고
    • American Chemical Society: Washington
    • For general reviews of molecular mechanics, see: (a) Burkert, U.; Allinger, N. L. Molecular Mechanics; American Chemical Society: Washington, 1982. (b) Brubaker, G. R.; Johnson, D. W. Coord. Chem. Rev. 1984, 53, 1. (c) Hancock, R. D. Prog. Inorg. Chem. 1989, 37, 187.
    • (1982) Molecular Mechanics
    • Burkert, U.1    Allinger, N.L.2
  • 15
    • 33751149724 scopus 로고
    • For general reviews of molecular mechanics, see: (a) Burkert, U.; Allinger, N. L. Molecular Mechanics; American Chemical Society: Washington, 1982. (b) Brubaker, G. R.; Johnson, D. W. Coord. Chem. Rev. 1984, 53, 1. (c) Hancock, R. D. Prog. Inorg. Chem. 1989, 37, 187.
    • (1984) Coord. Chem. Rev. , vol.53 , pp. 1
    • Brubaker, G.R.1    Johnson, D.W.2
  • 16
    • 0000244648 scopus 로고
    • For general reviews of molecular mechanics, see: (a) Burkert, U.; Allinger, N. L. Molecular Mechanics; American Chemical Society: Washington, 1982. (b) Brubaker, G. R.; Johnson, D. W. Coord. Chem. Rev. 1984, 53, 1. (c) Hancock, R. D. Prog. Inorg. Chem. 1989, 37, 187.
    • (1989) Prog. Inorg. Chem. , vol.37 , pp. 187
    • Hancock, R.D.1
  • 17
    • 0007851074 scopus 로고
    • For some representative examples of molecular mechanics calculations on metalcontaining systems, see: (d) Laier, T.; Larsen, E. Acta Chem. Scand. A 1979, 33, 257. (e) Lauher, J. W. J. Am. Chem. Soc. 1986, 108, 1521. (f) Brown, J. M.; Evans, P. L.; Lucy, A. R. J. Chem. Soc., Perkin Trans. II 1987, 1589. (g) Brown, J. M.: Evans, P. L. Tetrahedron 1988, 44, 4905. (h) Bogdan, P. L.: Irwin, J. J.; Bosnien, B. Organometallics 1989, 8, 1450. (i) Vedani, A.; Huhta, D. W. J. Am. Chem. Soc. 1990, 112, 4759. (J) Lin, Z.; Marks, T. J. J. Am. Chem. Soc. 1990, 112, 5515. (k) Mayo, S. L.; Olafson, B. D.; Goddard, W. A., III J. Phys. Chem. 1990, 94, 8897. (l) Ely, R. S.; Raja, M. Organometallics 1990, 9, 1500. (m) Allured, V. S.; Kelly, C. M.; Landis, C. R. J. Am. Chem. Soc. 1991, 113, 1. (n) Adam, K. R.; Antolovich, M.; Brigden, L. G.; Lindoy, L. F. J. Am. Chem. Soc. 1991, 113, 3346. (o) Lee, K. J.; Brown, T. L. Inorg. Chem. 1992, 31, 289. (p) Bernhardt, P. V.; Comba, P. Inorg. Chem. 1992, 31, 2638. (q) Rappé, A. K.; Casewit, C. J.; Colwell, K. S.; Goddard, W. A., III; Skiff, W. M. J. Am. Chem. Soc. 1992, 114, 10024. (r) Mackie, S. C.; Baird, M. C. Organometallics 1992, 11, 3112. (s) Polowin, J.: Mackie, S. C.; Baird, M. C. Organometallics 1992, 11, 3724. (t) Giovaaneni, J. S.; Kelly, C. M.; Laadis, C. R. J. Am. Chem. Soc. 1993, 115, 4040.
    • (1979) Acta Chem. Scand. A , vol.33 , pp. 257
    • Laier, T.1    Larsen, E.2
  • 18
    • 0001620081 scopus 로고
    • For some representative examples of molecular mechanics calculations on metalcontaining systems, see: (d) Laier, T.; Larsen, E. Acta Chem. Scand. A 1979, 33, 257. (e) Lauher, J. W. J. Am. Chem. Soc. 1986, 108, 1521. (f) Brown, J. M.; Evans, P. L.; Lucy, A. R. J. Chem. Soc., Perkin Trans. II 1987, 1589. (g) Brown, J. M.: Evans, P. L. Tetrahedron 1988, 44, 4905. (h) Bogdan, P. L.: Irwin, J. J.; Bosnien, B. Organometallics 1989, 8, 1450. (i) Vedani, A.; Huhta, D. W. J. Am. Chem. Soc. 1990, 112, 4759. (J) Lin, Z.; Marks, T. J. J. Am. Chem. Soc. 1990, 112, 5515. (k) Mayo, S. L.; Olafson, B. D.; Goddard, W. A., III J. Phys. Chem. 1990, 94, 8897. (l) Ely, R. S.; Raja, M. Organometallics 1990, 9, 1500. (m) Allured, V. S.; Kelly, C. M.; Landis, C. R. J. Am. Chem. Soc. 1991, 113, 1. (n) Adam, K. R.; Antolovich, M.; Brigden, L. G.; Lindoy, L. F. J. Am. Chem. Soc. 1991, 113, 3346. (o) Lee, K. J.; Brown, T. L. Inorg. Chem. 1992, 31, 289. (p) Bernhardt, P. V.; Comba, P. Inorg. Chem. 1992, 31, 2638. (q) Rappé, A. K.; Casewit, C. J.; Colwell, K. S.; Goddard, W. A., III; Skiff, W. M. J. Am. Chem. Soc. 1992, 114, 10024. (r) Mackie, S. C.; Baird, M. C. Organometallics 1992, 11, 3112. (s) Polowin, J.: Mackie, S. C.; Baird, M. C. Organometallics 1992, 11, 3724. (t) Giovaaneni, J. S.; Kelly, C. M.; Laadis, C. R. J. Am. Chem. Soc. 1993, 115, 4040.
    • (1986) J. Am. Chem. Soc. , vol.108 , pp. 1521
    • Lauher, J.W.1
  • 19
    • 37049070587 scopus 로고
    • For some representative examples of molecular mechanics calculations on metalcontaining systems, see: (d) Laier, T.; Larsen, E. Acta Chem. Scand. A 1979, 33, 257. (e) Lauher, J. W. J. Am. Chem. Soc. 1986, 108, 1521. (f) Brown, J. M.; Evans, P. L.; Lucy, A. R. J. Chem. Soc., Perkin Trans. II 1987, 1589. (g) Brown, J. M.: Evans, P. L. Tetrahedron 1988, 44, 4905. (h) Bogdan, P. L.: Irwin, J. J.; Bosnien, B. Organometallics 1989, 8, 1450. (i) Vedani, A.; Huhta, D. W. J. Am. Chem. Soc. 1990, 112, 4759. (J) Lin, Z.; Marks, T. J. J. Am. Chem. Soc. 1990, 112, 5515. (k) Mayo, S. L.; Olafson, B. D.; Goddard, W. A., III J. Phys. Chem. 1990, 94, 8897. (l) Ely, R. S.; Raja, M. Organometallics 1990, 9, 1500. (m) Allured, V. S.; Kelly, C. M.; Landis, C. R. J. Am. Chem. Soc. 1991, 113, 1. (n) Adam, K. R.; Antolovich, M.; Brigden, L. G.; Lindoy, L. F. J. Am. Chem. Soc. 1991, 113, 3346. (o) Lee, K. J.; Brown, T. L. Inorg. Chem. 1992, 31, 289. (p) Bernhardt, P. V.; Comba, P. Inorg. Chem. 1992, 31, 2638. (q) Rappé, A. K.; Casewit, C. J.; Colwell, K. S.; Goddard, W. A., III; Skiff, W. M. J. Am. Chem. Soc. 1992, 114, 10024. (r) Mackie, S. C.; Baird, M. C. Organometallics 1992, 11, 3112. (s) Polowin, J.: Mackie, S. C.; Baird, M. C. Organometallics 1992, 11, 3724. (t) Giovaaneni, J. S.; Kelly, C. M.; Laadis, C. R. J. Am. Chem. Soc. 1993, 115, 4040.
    • (1987) J. Chem. Soc., Perkin Trans. II , pp. 1589
    • Brown, J.M.1    Evans, P.L.2    Lucy, A.R.3
  • 20
    • 0000634303 scopus 로고
    • For some representative examples of molecular mechanics calculations on metalcontaining systems, see: (d) Laier, T.; Larsen, E. Acta Chem. Scand. A 1979, 33, 257. (e) Lauher, J. W. J. Am. Chem. Soc. 1986, 108, 1521. (f) Brown, J. M.; Evans, P. L.; Lucy, A. R. J. Chem. Soc., Perkin Trans. II 1987, 1589. (g) Brown, J. M.: Evans, P. L. Tetrahedron 1988, 44, 4905. (h) Bogdan, P. L.: Irwin, J. J.; Bosnien, B. Organometallics 1989, 8, 1450. (i) Vedani, A.; Huhta, D. W. J. Am. Chem. Soc. 1990, 112, 4759. (J) Lin, Z.; Marks, T. J. J. Am. Chem. Soc. 1990, 112, 5515. (k) Mayo, S. L.; Olafson, B. D.; Goddard, W. A., III J. Phys. Chem. 1990, 94, 8897. (l) Ely, R. S.; Raja, M. Organometallics 1990, 9, 1500. (m) Allured, V. S.; Kelly, C. M.; Landis, C. R. J. Am. Chem. Soc. 1991, 113, 1. (n) Adam, K. R.; Antolovich, M.; Brigden, L. G.; Lindoy, L. F. J. Am. Chem. Soc. 1991, 113, 3346. (o) Lee, K. J.; Brown, T. L. Inorg. Chem. 1992, 31, 289. (p) Bernhardt, P. V.; Comba, P. Inorg. Chem. 1992, 31, 2638. (q) Rappé, A. K.; Casewit, C. J.; Colwell, K. S.; Goddard, W. A., III; Skiff, W. M. J. Am. Chem. Soc. 1992, 114, 10024. (r) Mackie, S. C.; Baird, M. C. Organometallics 1992, 11, 3112. (s) Polowin, J.: Mackie, S. C.; Baird, M. C. Organometallics 1992, 11, 3724. (t) Giovaaneni, J. S.; Kelly, C. M.; Laadis, C. R. J. Am. Chem. Soc. 1993, 115, 4040.
    • (1988) Tetrahedron , vol.44 , pp. 4905
    • Brown, J.M.1    Evans, P.L.2
  • 21
    • 0024683997 scopus 로고
    • For some representative examples of molecular mechanics calculations on metalcontaining systems, see: (d) Laier, T.; Larsen, E. Acta Chem. Scand. A 1979, 33, 257. (e) Lauher, J. W. J. Am. Chem. Soc. 1986, 108, 1521. (f) Brown, J. M.; Evans, P. L.; Lucy, A. R. J. Chem. Soc., Perkin Trans. II 1987, 1589. (g) Brown, J. M.: Evans, P. L. Tetrahedron 1988, 44, 4905. (h) Bogdan, P. L.: Irwin, J. J.; Bosnien, B. Organometallics 1989, 8, 1450. (i) Vedani, A.; Huhta, D. W. J. Am. Chem. Soc. 1990, 112, 4759. (J) Lin, Z.; Marks, T. J. J. Am. Chem. Soc. 1990, 112, 5515. (k) Mayo, S. L.; Olafson, B. D.; Goddard, W. A., III J. Phys. Chem. 1990, 94, 8897. (l) Ely, R. S.; Raja, M. Organometallics 1990, 9, 1500. (m) Allured, V. S.; Kelly, C. M.; Landis, C. R. J. Am. Chem. Soc. 1991, 113, 1. (n) Adam, K. R.; Antolovich, M.; Brigden, L. G.; Lindoy, L. F. J. Am. Chem. Soc. 1991, 113, 3346. (o) Lee, K. J.; Brown, T. L. Inorg. Chem. 1992, 31, 289. (p) Bernhardt, P. V.; Comba, P. Inorg. Chem. 1992, 31, 2638. (q) Rappé, A. K.; Casewit, C. J.; Colwell, K. S.; Goddard, W. A., III; Skiff, W. M. J. Am. Chem. Soc. 1992, 114, 10024. (r) Mackie, S. C.; Baird, M. C. Organometallics 1992, 11, 3112. (s) Polowin, J.: Mackie, S. C.; Baird, M. C. Organometallics 1992, 11, 3724. (t) Giovaaneni, J. S.; Kelly, C. M.; Laadis, C. R. J. Am. Chem. Soc. 1993, 115, 4040.
    • (1989) Organometallics , vol.8 , pp. 1450
    • Bogdan, P.L.1    Irwin, J.J.2    Bosnien, B.3
  • 22
    • 0025158237 scopus 로고
    • For some representative examples of molecular mechanics calculations on metalcontaining systems, see: (d) Laier, T.; Larsen, E. Acta Chem. Scand. A 1979, 33, 257. (e) Lauher, J. W. J. Am. Chem. Soc. 1986, 108, 1521. (f) Brown, J. M.; Evans, P. L.; Lucy, A. R. J. Chem. Soc., Perkin Trans. II 1987, 1589. (g) Brown, J. M.: Evans, P. L. Tetrahedron 1988, 44, 4905. (h) Bogdan, P. L.: Irwin, J. J.; Bosnien, B. Organometallics 1989, 8, 1450. (i) Vedani, A.; Huhta, D. W. J. Am. Chem. Soc. 1990, 112, 4759. (J) Lin, Z.; Marks, T. J. J. Am. Chem. Soc. 1990, 112, 5515. (k) Mayo, S. L.; Olafson, B. D.; Goddard, W. A., III J. Phys. Chem. 1990, 94, 8897. (l) Ely, R. S.; Raja, M. Organometallics 1990, 9, 1500. (m) Allured, V. S.; Kelly, C. M.; Landis, C. R. J. Am. Chem. Soc. 1991, 113, 1. (n) Adam, K. R.; Antolovich, M.; Brigden, L. G.; Lindoy, L. F. J. Am. Chem. Soc. 1991, 113, 3346. (o) Lee, K. J.; Brown, T. L. Inorg. Chem. 1992, 31, 289. (p) Bernhardt, P. V.; Comba, P. Inorg. Chem. 1992, 31, 2638. (q) Rappé, A. K.; Casewit, C. J.; Colwell, K. S.; Goddard, W. A., III; Skiff, W. M. J. Am. Chem. Soc. 1992, 114, 10024. (r) Mackie, S. C.; Baird, M. C. Organometallics 1992, 11, 3112. (s) Polowin, J.: Mackie, S. C.; Baird, M. C. Organometallics 1992, 11, 3724. (t) Giovaaneni, J. S.; Kelly, C. M.; Laadis, C. R. J. Am. Chem. Soc. 1993, 115, 4040.
    • (1990) J. Am. Chem. Soc. , vol.112 , pp. 4759
    • Vedani, A.1    Huhta, D.W.2
  • 23
    • 0001543207 scopus 로고
    • For some representative examples of molecular mechanics calculations on metalcontaining systems, see: (d) Laier, T.; Larsen, E. Acta Chem. Scand. A 1979, 33, 257. (e) Lauher, J. W. J. Am. Chem. Soc. 1986, 108, 1521. (f) Brown, J. M.; Evans, P. L.; Lucy, A. R. J. Chem. Soc., Perkin Trans. II 1987, 1589. (g) Brown, J. M.: Evans, P. L. Tetrahedron 1988, 44, 4905. (h) Bogdan, P. L.: Irwin, J. J.; Bosnien, B. Organometallics 1989, 8, 1450. (i) Vedani, A.; Huhta, D. W. J. Am. Chem. Soc. 1990, 112, 4759. (J) Lin, Z.; Marks, T. J. J. Am. Chem. Soc. 1990, 112, 5515. (k) Mayo, S. L.; Olafson, B. D.; Goddard, W. A., III J. Phys. Chem. 1990, 94, 8897. (l) Ely, R. S.; Raja, M. Organometallics 1990, 9, 1500. (m) Allured, V. S.; Kelly, C. M.; Landis, C. R. J. Am. Chem. Soc. 1991, 113, 1. (n) Adam, K. R.; Antolovich, M.; Brigden, L. G.; Lindoy, L. F. J. Am. Chem. Soc. 1991, 113, 3346. (o) Lee, K. J.; Brown, T. L. Inorg. Chem. 1992, 31, 289. (p) Bernhardt, P. V.; Comba, P. Inorg. Chem. 1992, 31, 2638. (q) Rappé, A. K.; Casewit, C. J.; Colwell, K. S.; Goddard, W. A., III; Skiff, W. M. J. Am. Chem. Soc. 1992, 114, 10024. (r) Mackie, S. C.; Baird, M. C. Organometallics 1992, 11, 3112. (s) Polowin, J.: Mackie, S. C.; Baird, M. C. Organometallics 1992, 11, 3724. (t) Giovaaneni, J. S.; Kelly, C. M.; Laadis, C. R. J. Am. Chem. Soc. 1993, 115, 4040.
    • (1990) J. Am. Chem. Soc. , vol.112 , pp. 5515
    • Lin, Z.1    Marks, T.J.2
  • 24
    • 9144240095 scopus 로고
    • For some representative examples of molecular mechanics calculations on metalcontaining systems, see: (d) Laier, T.; Larsen, E. Acta Chem. Scand. A 1979, 33, 257. (e) Lauher, J. W. J. Am. Chem. Soc. 1986, 108, 1521. (f) Brown, J. M.; Evans, P. L.; Lucy, A. R. J. Chem. Soc., Perkin Trans. II 1987, 1589. (g) Brown, J. M.: Evans, P. L. Tetrahedron 1988, 44, 4905. (h) Bogdan, P. L.: Irwin, J. J.; Bosnien, B. Organometallics 1989, 8, 1450. (i) Vedani, A.; Huhta, D. W. J. Am. Chem. Soc. 1990, 112, 4759. (J) Lin, Z.; Marks, T. J. J. Am. Chem. Soc. 1990, 112, 5515. (k) Mayo, S. L.; Olafson, B. D.; Goddard, W. A., III J. Phys. Chem. 1990, 94, 8897. (l) Ely, R. S.; Raja, M. Organometallics 1990, 9, 1500. (m) Allured, V. S.; Kelly, C. M.; Landis, C. R. J. Am. Chem. Soc. 1991, 113, 1. (n) Adam, K. R.; Antolovich, M.; Brigden, L. G.; Lindoy, L. F. J. Am. Chem. Soc. 1991, 113, 3346. (o) Lee, K. J.; Brown, T. L. Inorg. Chem. 1992, 31, 289. (p) Bernhardt, P. V.; Comba, P. Inorg. Chem. 1992, 31, 2638. (q) Rappé, A. K.; Casewit, C. J.; Colwell, K. S.; Goddard, W. A., III; Skiff, W. M. J. Am. Chem. Soc. 1992, 114, 10024. (r) Mackie, S. C.; Baird, M. C. Organometallics 1992, 11, 3112. (s) Polowin, J.: Mackie, S. C.; Baird, M. C. Organometallics 1992, 11, 3724. (t) Giovaaneni, J. S.; Kelly, C. M.; Laadis, C. R. J. Am. Chem. Soc. 1993, 115, 4040.
    • (1990) J. Phys. Chem. , vol.94 , pp. 8897
    • Mayo, S.L.1    Olafson, B.D.2    Goddard III, W.A.3
  • 25
    • 84889527878 scopus 로고
    • For some representative examples of molecular mechanics calculations on metalcontaining systems, see: (d) Laier, T.; Larsen, E. Acta Chem. Scand. A 1979, 33, 257. (e) Lauher, J. W. J. Am. Chem. Soc. 1986, 108, 1521. (f) Brown, J. M.; Evans, P. L.; Lucy, A. R. J. Chem. Soc., Perkin Trans. II 1987, 1589. (g) Brown, J. M.: Evans, P. L. Tetrahedron 1988, 44, 4905. (h) Bogdan, P. L.: Irwin, J. J.; Bosnien, B. Organometallics 1989, 8, 1450. (i) Vedani, A.; Huhta, D. W. J. Am. Chem. Soc. 1990, 112, 4759. (J) Lin, Z.; Marks, T. J. J. Am. Chem. Soc. 1990, 112, 5515. (k) Mayo, S. L.; Olafson, B. D.; Goddard, W. A., III J. Phys. Chem. 1990, 94, 8897. (l) Ely, R. S.; Raja, M. Organometallics 1990, 9, 1500. (m) Allured, V. S.; Kelly, C. M.; Landis, C. R. J. Am. Chem. Soc. 1991, 113, 1. (n) Adam, K. R.; Antolovich, M.; Brigden, L. G.; Lindoy, L. F. J. Am. Chem. Soc. 1991, 113, 3346. (o) Lee, K. J.; Brown, T. L. Inorg. Chem. 1992, 31, 289. (p) Bernhardt, P. V.; Comba, P. Inorg. Chem. 1992, 31, 2638. (q) Rappé, A. K.; Casewit, C. J.; Colwell, K. S.; Goddard, W. A., III; Skiff, W. M. J. Am. Chem. Soc. 1992, 114, 10024. (r) Mackie, S. C.; Baird, M. C. Organometallics 1992, 11, 3112. (s) Polowin, J.: Mackie, S. C.; Baird, M. C. Organometallics 1992, 11, 3724. (t) Giovaaneni, J. S.; Kelly, C. M.; Laadis, C. R. J. Am. Chem. Soc. 1993, 115, 4040.
    • (1990) Organometallics , vol.9 , pp. 1500
    • Ely, R.S.1    Raja, M.2
  • 26
    • 84954696353 scopus 로고
    • For some representative examples of molecular mechanics calculations on metalcontaining systems, see: (d) Laier, T.; Larsen, E. Acta Chem. Scand. A 1979, 33, 257. (e) Lauher, J. W. J. Am. Chem. Soc. 1986, 108, 1521. (f) Brown, J. M.; Evans, P. L.; Lucy, A. R. J. Chem. Soc., Perkin Trans. II 1987, 1589. (g) Brown, J. M.: Evans, P. L. Tetrahedron 1988, 44, 4905. (h) Bogdan, P. L.: Irwin, J. J.; Bosnien, B. Organometallics 1989, 8, 1450. (i) Vedani, A.; Huhta, D. W. J. Am. Chem. Soc. 1990, 112, 4759. (J) Lin, Z.; Marks, T. J. J. Am. Chem. Soc. 1990, 112, 5515. (k) Mayo, S. L.; Olafson, B. D.; Goddard, W. A., III J. Phys. Chem. 1990, 94, 8897. (l) Ely, R. S.; Raja, M. Organometallics 1990, 9, 1500. (m) Allured, V. S.; Kelly, C. M.; Landis, C. R. J. Am. Chem. Soc. 1991, 113, 1. (n) Adam, K. R.; Antolovich, M.; Brigden, L. G.; Lindoy, L. F. J. Am. Chem. Soc. 1991, 113, 3346. (o) Lee, K. J.; Brown, T. L. Inorg. Chem. 1992, 31, 289. (p) Bernhardt, P. V.; Comba, P. Inorg. Chem. 1992, 31, 2638. (q) Rappé, A. K.; Casewit, C. J.; Colwell, K. S.; Goddard, W. A., III; Skiff, W. M. J. Am. Chem. Soc. 1992, 114, 10024. (r) Mackie, S. C.; Baird, M. C. Organometallics 1992, 11, 3112. (s) Polowin, J.: Mackie, S. C.; Baird, M. C. Organometallics 1992, 11, 3724. (t) Giovaaneni, J. S.; Kelly, C. M.; Laadis, C. R. J. Am. Chem. Soc. 1993, 115, 4040.
    • (1991) J. Am. Chem. Soc. , vol.113 , pp. 1
    • Allured, V.S.1    Kelly, C.M.2    Landis, C.R.3
  • 27
    • 0001687047 scopus 로고
    • For some representative examples of molecular mechanics calculations on metalcontaining systems, see: (d) Laier, T.; Larsen, E. Acta Chem. Scand. A 1979, 33, 257. (e) Lauher, J. W. J. Am. Chem. Soc. 1986, 108, 1521. (f) Brown, J. M.; Evans, P. L.; Lucy, A. R. J. Chem. Soc., Perkin Trans. II 1987, 1589. (g) Brown, J. M.: Evans, P. L. Tetrahedron 1988, 44, 4905. (h) Bogdan, P. L.: Irwin, J. J.; Bosnien, B. Organometallics 1989, 8, 1450. (i) Vedani, A.; Huhta, D. W. J. Am. Chem. Soc. 1990, 112, 4759. (J) Lin, Z.; Marks, T. J. J. Am. Chem. Soc. 1990, 112, 5515. (k) Mayo, S. L.; Olafson, B. D.; Goddard, W. A., III J. Phys. Chem. 1990, 94, 8897. (l) Ely, R. S.; Raja, M. Organometallics 1990, 9, 1500. (m) Allured, V. S.; Kelly, C. M.; Landis, C. R. J. Am. Chem. Soc. 1991, 113, 1. (n) Adam, K. R.; Antolovich, M.; Brigden, L. G.; Lindoy, L. F. J. Am. Chem. Soc. 1991, 113, 3346. (o) Lee, K. J.; Brown, T. L. Inorg. Chem. 1992, 31, 289. (p) Bernhardt, P. V.; Comba, P. Inorg. Chem. 1992, 31, 2638. (q) Rappé, A. K.; Casewit, C. J.; Colwell, K. S.; Goddard, W. A., III; Skiff, W. M. J. Am. Chem. Soc. 1992, 114, 10024. (r) Mackie, S. C.; Baird, M. C. Organometallics 1992, 11, 3112. (s) Polowin, J.: Mackie, S. C.; Baird, M. C. Organometallics 1992, 11, 3724. (t) Giovaaneni, J. S.; Kelly, C. M.; Laadis, C. R. J. Am. Chem. Soc. 1993, 115, 4040.
    • (1991) J. Am. Chem. Soc. , vol.113 , pp. 3346
    • Adam, K.R.1    Antolovich, M.2    Brigden, L.G.3    Lindoy, L.F.4
  • 28
    • 0000729692 scopus 로고
    • For some representative examples of molecular mechanics calculations on metalcontaining systems, see: (d) Laier, T.; Larsen, E. Acta Chem. Scand. A 1979, 33, 257. (e) Lauher, J. W. J. Am. Chem. Soc. 1986, 108, 1521. (f) Brown, J. M.; Evans, P. L.; Lucy, A. R. J. Chem. Soc., Perkin Trans. II 1987, 1589. (g) Brown, J. M.: Evans, P. L. Tetrahedron 1988, 44, 4905. (h) Bogdan, P. L.: Irwin, J. J.; Bosnien, B. Organometallics 1989, 8, 1450. (i) Vedani, A.; Huhta, D. W. J. Am. Chem. Soc. 1990, 112, 4759. (J) Lin, Z.; Marks, T. J. J. Am. Chem. Soc. 1990, 112, 5515. (k) Mayo, S. L.; Olafson, B. D.; Goddard, W. A., III J. Phys. Chem. 1990, 94, 8897. (l) Ely, R. S.; Raja, M. Organometallics 1990, 9, 1500. (m) Allured, V. S.; Kelly, C. M.; Landis, C. R. J. Am. Chem. Soc. 1991, 113, 1. (n) Adam, K. R.; Antolovich, M.; Brigden, L. G.; Lindoy, L. F. J. Am. Chem. Soc. 1991, 113, 3346. (o) Lee, K. J.; Brown, T. L. Inorg. Chem. 1992, 31, 289. (p) Bernhardt, P. V.; Comba, P. Inorg. Chem. 1992, 31, 2638. (q) Rappé, A. K.; Casewit, C. J.; Colwell, K. S.; Goddard, W. A., III; Skiff, W. M. J. Am. Chem. Soc. 1992, 114, 10024. (r) Mackie, S. C.; Baird, M. C. Organometallics 1992, 11, 3112. (s) Polowin, J.: Mackie, S. C.; Baird, M. C. Organometallics 1992, 11, 3724. (t) Giovaaneni, J. S.; Kelly, C. M.; Laadis, C. R. J. Am. Chem. Soc. 1993, 115, 4040.
    • (1992) Inorg. Chem. , vol.31 , pp. 289
    • Lee, K.J.1    Brown, T.L.2
  • 29
    • 33751391441 scopus 로고
    • For some representative examples of molecular mechanics calculations on metalcontaining systems, see: (d) Laier, T.; Larsen, E. Acta Chem. Scand. A 1979, 33, 257. (e) Lauher, J. W. J. Am. Chem. Soc. 1986, 108, 1521. (f) Brown, J. M.; Evans, P. L.; Lucy, A. R. J. Chem. Soc., Perkin Trans. II 1987, 1589. (g) Brown, J. M.: Evans, P. L. Tetrahedron 1988, 44, 4905. (h) Bogdan, P. L.: Irwin, J. J.; Bosnien, B. Organometallics 1989, 8, 1450. (i) Vedani, A.; Huhta, D. W. J. Am. Chem. Soc. 1990, 112, 4759. (J) Lin, Z.; Marks, T. J. J. Am. Chem. Soc. 1990, 112, 5515. (k) Mayo, S. L.; Olafson, B. D.; Goddard, W. A., III J. Phys. Chem. 1990, 94, 8897. (l) Ely, R. S.; Raja, M. Organometallics 1990, 9, 1500. (m) Allured, V. S.; Kelly, C. M.; Landis, C. R. J. Am. Chem. Soc. 1991, 113, 1. (n) Adam, K. R.; Antolovich, M.; Brigden, L. G.; Lindoy, L. F. J. Am. Chem. Soc. 1991, 113, 3346. (o) Lee, K. J.; Brown, T. L. Inorg. Chem. 1992, 31, 289. (p) Bernhardt, P. V.; Comba, P. Inorg. Chem. 1992, 31, 2638. (q) Rappé, A. K.; Casewit, C. J.; Colwell, K. S.; Goddard, W. A., III; Skiff, W. M. J. Am. Chem. Soc. 1992, 114, 10024. (r) Mackie, S. C.; Baird, M. C. Organometallics 1992, 11, 3112. (s) Polowin, J.: Mackie, S. C.; Baird, M. C. Organometallics 1992, 11, 3724. (t) Giovaaneni, J. S.; Kelly, C. M.; Laadis, C. R. J. Am. Chem. Soc. 1993, 115, 4040.
    • (1992) Inorg. Chem. , vol.31 , pp. 2638
    • Bernhardt, P.V.1    Comba, P.2
  • 30
    • 0042041206 scopus 로고
    • For some representative examples of molecular mechanics calculations on metalcontaining systems, see: (d) Laier, T.; Larsen, E. Acta Chem. Scand. A 1979, 33, 257. (e) Lauher, J. W. J. Am. Chem. Soc. 1986, 108, 1521. (f) Brown, J. M.; Evans, P. L.; Lucy, A. R. J. Chem. Soc., Perkin Trans. II 1987, 1589. (g) Brown, J. M.: Evans, P. L. Tetrahedron 1988, 44, 4905. (h) Bogdan, P. L.: Irwin, J. J.; Bosnien, B. Organometallics 1989, 8, 1450. (i) Vedani, A.; Huhta, D. W. J. Am. Chem. Soc. 1990, 112, 4759. (J) Lin, Z.; Marks, T. J. J. Am. Chem. Soc. 1990, 112, 5515. (k) Mayo, S. L.; Olafson, B. D.; Goddard, W. A., III J. Phys. Chem. 1990, 94, 8897. (l) Ely, R. S.; Raja, M. Organometallics 1990, 9, 1500. (m) Allured, V. S.; Kelly, C. M.; Landis, C. R. J. Am. Chem. Soc. 1991, 113, 1. (n) Adam, K. R.; Antolovich, M.; Brigden, L. G.; Lindoy, L. F. J. Am. Chem. Soc. 1991, 113, 3346. (o) Lee, K. J.; Brown, T. L. Inorg. Chem. 1992, 31, 289. (p) Bernhardt, P. V.; Comba, P. Inorg. Chem. 1992, 31, 2638. (q) Rappé, A. K.; Casewit, C. J.; Colwell, K. S.; Goddard, W. A., III; Skiff, W. M. J. Am. Chem. Soc. 1992, 114, 10024. (r) Mackie, S. C.; Baird, M. C. Organometallics 1992, 11, 3112. (s) Polowin, J.: Mackie, S. C.; Baird, M. C. Organometallics 1992, 11, 3724. (t) Giovaaneni, J. S.; Kelly, C. M.; Laadis, C. R. J. Am. Chem. Soc. 1993, 115, 4040.
    • (1992) J. Am. Chem. Soc. , vol.114 , pp. 10024
    • Rappé, A.K.1    Casewit, C.J.2    Colwell, K.S.3    Goddard III, W.A.4    Skiff, W.M.5
  • 31
    • 84889541546 scopus 로고
    • For some representative examples of molecular mechanics calculations on metalcontaining systems, see: (d) Laier, T.; Larsen, E. Acta Chem. Scand. A 1979, 33, 257. (e) Lauher, J. W. J. Am. Chem. Soc. 1986, 108, 1521. (f) Brown, J. M.; Evans, P. L.; Lucy, A. R. J. Chem. Soc., Perkin Trans. II 1987, 1589. (g) Brown, J. M.: Evans, P. L. Tetrahedron 1988, 44, 4905. (h) Bogdan, P. L.: Irwin, J. J.; Bosnien, B. Organometallics 1989, 8, 1450. (i) Vedani, A.; Huhta, D. W. J. Am. Chem. Soc. 1990, 112, 4759. (J) Lin, Z.; Marks, T. J. J. Am. Chem. Soc. 1990, 112, 5515. (k) Mayo, S. L.; Olafson, B. D.; Goddard, W. A., III J. Phys. Chem. 1990, 94, 8897. (l) Ely, R. S.; Raja, M. Organometallics 1990, 9, 1500. (m) Allured, V. S.; Kelly, C. M.; Landis, C. R. J. Am. Chem. Soc. 1991, 113, 1. (n) Adam, K. R.; Antolovich, M.; Brigden, L. G.; Lindoy, L. F. J. Am. Chem. Soc. 1991, 113, 3346. (o) Lee, K. J.; Brown, T. L. Inorg. Chem. 1992, 31, 289. (p) Bernhardt, P. V.; Comba, P. Inorg. Chem. 1992, 31, 2638. (q) Rappé, A. K.; Casewit, C. J.; Colwell, K. S.; Goddard, W. A., III; Skiff, W. M. J. Am. Chem. Soc. 1992, 114, 10024. (r) Mackie, S. C.; Baird, M. C. Organometallics 1992, 11, 3112. (s) Polowin, J.: Mackie, S. C.; Baird, M. C. Organometallics 1992, 11, 3724. (t) Giovaaneni, J. S.; Kelly, C. M.; Laadis, C. R. J. Am. Chem. Soc. 1993, 115, 4040.
    • (1992) Organometallics , vol.11 , pp. 3112
    • Mackie, S.C.1    Baird, M.C.2
  • 32
    • 1542619165 scopus 로고
    • For some representative examples of molecular mechanics calculations on metalcontaining systems, see: (d) Laier, T.; Larsen, E. Acta Chem. Scand. A 1979, 33, 257. (e) Lauher, J. W. J. Am. Chem. Soc. 1986, 108, 1521. (f) Brown, J. M.; Evans, P. L.; Lucy, A. R. J. Chem. Soc., Perkin Trans. II 1987, 1589. (g) Brown, J. M.: Evans, P. L. Tetrahedron 1988, 44, 4905. (h) Bogdan, P. L.: Irwin, J. J.; Bosnien, B. Organometallics 1989, 8, 1450. (i) Vedani, A.; Huhta, D. W. J. Am. Chem. Soc. 1990, 112, 4759. (J) Lin, Z.; Marks, T. J. J. Am. Chem. Soc. 1990, 112, 5515. (k) Mayo, S. L.; Olafson, B. D.; Goddard, W. A., III J. Phys. Chem. 1990, 94, 8897. (l) Ely, R. S.; Raja, M. Organometallics 1990, 9, 1500. (m) Allured, V. S.; Kelly, C. M.; Landis, C. R. J. Am. Chem. Soc. 1991, 113, 1. (n) Adam, K. R.; Antolovich, M.; Brigden, L. G.; Lindoy, L. F. J. Am. Chem. Soc. 1991, 113, 3346. (o) Lee, K. J.; Brown, T. L. Inorg. Chem. 1992, 31, 289. (p) Bernhardt, P. V.; Comba, P. Inorg. Chem. 1992, 31, 2638. (q) Rappé, A. K.; Casewit, C. J.; Colwell, K. S.; Goddard, W. A., III; Skiff, W. M. J. Am. Chem. Soc. 1992, 114, 10024. (r) Mackie, S. C.; Baird, M. C. Organometallics 1992, 11, 3112. (s) Polowin, J.: Mackie, S. C.; Baird, M. C. Organometallics 1992, 11, 3724. (t) Giovaaneni, J. S.; Kelly, C. M.; Laadis, C. R. J. Am. Chem. Soc. 1993, 115, 4040.
    • (1992) Organometallics , vol.11 , pp. 3724
    • Polowin, J.1    Mackie, S.C.2    Baird, M.C.3
  • 33
    • 0000935935 scopus 로고
    • For some representative examples of molecular mechanics calculations on metalcontaining systems, see: (d) Laier, T.; Larsen, E. Acta Chem. Scand. A 1979, 33, 257. (e) Lauher, J. W. J. Am. Chem. Soc. 1986, 108, 1521. (f) Brown, J. M.; Evans, P. L.; Lucy, A. R. J. Chem. Soc., Perkin Trans. II 1987, 1589. (g) Brown, J. M.: Evans, P. L. Tetrahedron 1988, 44, 4905. (h) Bogdan, P. L.: Irwin, J. J.; Bosnien, B. Organometallics 1989, 8, 1450. (i) Vedani, A.; Huhta, D. W. J. Am. Chem. Soc. 1990, 112, 4759. (J) Lin, Z.; Marks, T. J. J. Am. Chem. Soc. 1990, 112, 5515. (k) Mayo, S. L.; Olafson, B. D.; Goddard, W. A., III J. Phys. Chem. 1990, 94, 8897. (l) Ely, R. S.; Raja, M. Organometallics 1990, 9, 1500. (m) Allured, V. S.; Kelly, C. M.; Landis, C. R. J. Am. Chem. Soc. 1991, 113, 1. (n) Adam, K. R.; Antolovich, M.; Brigden, L. G.; Lindoy, L. F. J. Am. Chem. Soc. 1991, 113, 3346. (o) Lee, K. J.; Brown, T. L. Inorg. Chem. 1992, 31, 289. (p) Bernhardt, P. V.; Comba, P. Inorg. Chem. 1992, 31, 2638. (q) Rappé, A. K.; Casewit, C. J.; Colwell, K. S.; Goddard, W. A., III; Skiff, W. M. J. Am. Chem. Soc. 1992, 114, 10024. (r) Mackie, S. C.; Baird, M. C. Organometallics 1992, 11, 3112. (s) Polowin, J.: Mackie, S. C.; Baird, M. C. Organometallics 1992, 11, 3724. (t) Giovaaneni, J. S.; Kelly, C. M.; Laadis, C. R. J. Am. Chem. Soc. 1993, 115, 4040.
    • (1993) J. Am. Chem. Soc. , vol.115 , pp. 4040
    • Giovaaneni, J.S.1    Kelly, C.M.2    Laadis, C.R.3
  • 34
    • 0002103621 scopus 로고
    • 3-allylpalladium complexes, see: (u) Pregosin, P. S.; Rüegger, H.; Salzmann, R.; Albinati, A.; Lianza, F.; Kunz, R. W. Organometallics 1994, 13, 83. (v) Gugelchuk, M. M.; Houk, K. N. J. Am. Chem. Soc. 1994, 116, 330. (w) Trost, B. M.; Breit, B.; Organ. M. G. Tetrahedron Lett. 1994, 55, 5817. (x) Barbare, P.; Pregosin, P. S.; Salzmann, R.; Albinati, A.; Kunz, R. W. Organometaliics 1995, 14, 5160. (y) Taber, D. F.: You, K. K.; Rheingold. A. L. J. Am. Chem. Soc. 1996, 118, 547. For another extensive bibliography, see ref 3r.
    • (1994) Organometallics , vol.13 , pp. 83
    • Pregosin, P.S.1    Rüegger, H.2    Salzmann, R.3    Albinati, A.4    Lianza, F.5    Kunz, R.W.6
  • 35
    • 0028316724 scopus 로고
    • 3-allylpalladium complexes, see: (u) Pregosin, P. S.; Rüegger, H.; Salzmann, R.; Albinati, A.; Lianza, F.; Kunz, R. W. Organometallics 1994, 13, 83. (v) Gugelchuk, M. M.; Houk, K. N. J. Am. Chem. Soc. 1994, 116, 330. (w) Trost, B. M.; Breit, B.; Organ. M. G. Tetrahedron Lett. 1994, 55, 5817. (x) Barbare, P.; Pregosin, P. S.; Salzmann, R.; Albinati, A.; Kunz, R. W. Organometaliics 1995, 14, 5160. (y) Taber, D. F.: You, K. K.; Rheingold. A. L. J. Am. Chem. Soc. 1996, 118, 547. For another extensive bibliography, see ref 3r.
    • (1994) Am. Chem. Soc. , vol.116 , pp. 330
    • Gugelchuk, M.M.1    Houk, K.N.J.2
  • 36
    • 0028022655 scopus 로고
    • 3-allylpalladium complexes, see: (u) Pregosin, P. S.; Rüegger, H.; Salzmann, R.; Albinati, A.; Lianza, F.; Kunz, R. W. Organometallics 1994, 13, 83. (v) Gugelchuk, M. M.; Houk, K. N. J. Am. Chem. Soc. 1994, 116, 330. (w) Trost, B. M.; Breit, B.; Organ. M. G. Tetrahedron Lett. 1994, 55, 5817. (x) Barbare, P.; Pregosin, P. S.; Salzmann, R.; Albinati, A.; Kunz, R. W. Organometaliics 1995, 14, 5160. (y) Taber, D. F.: You, K. K.; Rheingold. A. L. J. Am. Chem. Soc. 1996, 118, 547. For another extensive bibliography, see ref 3r.
    • (1994) Tetrahedron Lett. , vol.55 , pp. 5817
    • Trost, B.M.1    Breit, B.2    Organ, M.G.3
  • 37
    • 0000506851 scopus 로고
    • 3-allylpalladium complexes, see: (u) Pregosin, P. S.; Rüegger, H.; Salzmann, R.; Albinati, A.; Lianza, F.; Kunz, R. W. Organometallics 1994, 13, 83. (v) Gugelchuk, M. M.; Houk, K. N. J. Am. Chem. Soc. 1994, 116, 330. (w) Trost, B. M.; Breit, B.; Organ. M. G. Tetrahedron Lett. 1994, 55, 5817. (x) Barbare, P.; Pregosin, P. S.; Salzmann, R.; Albinati, A.; Kunz, R. W. Organometaliics 1995, 14, 5160. (y) Taber, D. F.: You, K. K.; Rheingold. A. L. J. Am. Chem. Soc. 1996, 118, 547. For another extensive bibliography, see ref 3r.
    • (1995) Organometaliics , vol.14 , pp. 5160
    • Barbare, P.1    Pregosin, P.S.2    Salzmann, R.3    Albinati, A.4    Kunz, R.W.5
  • 38
    • 0000593386 scopus 로고    scopus 로고
    • For another extensive bibliography, see ref 3r
    • 3-allylpalladium complexes, see: (u) Pregosin, P. S.; Rüegger, H.; Salzmann, R.; Albinati, A.; Lianza, F.; Kunz, R. W. Organometallics 1994, 13, 83. (v) Gugelchuk, M. M.; Houk, K. N. J. Am. Chem. Soc. 1994, 116, 330. (w) Trost, B. M.; Breit, B.; Organ. M. G. Tetrahedron Lett. 1994, 55, 5817. (x) Barbare, P.; Pregosin, P. S.; Salzmann, R.; Albinati, A.; Kunz, R. W. Organometaliics 1995, 14, 5160. (y) Taber, D. F.: You, K. K.; Rheingold. A. L. J. Am. Chem. Soc. 1996, 118, 547. For another extensive bibliography, see ref 3r.
    • (1996) J. Am. Chem. Soc. , vol.118 , pp. 547
    • Taber, D.F.1    You, K.K.2    Rheingold, A.L.3
  • 42
    • 84889525372 scopus 로고    scopus 로고
    • Tentative parameters were utilized for phenyl substituents on the allyl moiety; Norrby. P.-O., unpublished data. The complete set of parameters utilized in this work is available upon request from P.O.N. via e-mail: peon@medchem.dfh.dk.
    • (d) Tentative parameters were utilized for phenyl substituents on the allyl moiety; Norrby. P.-O., unpublished data. The complete set of parameters utilized in this work is available upon request from P.O.N. via e-mail: peon@medchem.dfh.dk.
  • 61
    • 0001890535 scopus 로고
    • The Enraf-Nonius CAD4 SDP - A Real-Time System for Concurrent X-Ray Data Collection and Crystal Structure Solution
    • Schenk, H.: Olthof-Hazelkamp, R., van Konigsveld, H., Bassi, G. C., Eds.; Delft University Press: Delft, The Netherlands
    • Frenz, B. A. The Enraf-Nonius CAD4 SDP - A Real-Time System for Concurrent X-Ray Data Collection and Crystal Structure Solution In Computing in Crystallography; Schenk, H.: Olthof-Hazelkamp, R., van Konigsveld, H., Bassi, G. C., Eds.; Delft University Press: Delft, The Netherlands, 1978: pp 64-71.
    • (1978) Computing in Crystallography , pp. 64-71
    • Frenz, B.A.1


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