Unraveling the origin of the peculiar reaction field of triruthenium ring core structures

Journal of the American Chemical Society

Volumn 129, Issue 45, 2007, Pages 13905-13922

  Tsipis, Athanassios C ^a   Kefalidis, Christos E ^b   Tsipis, Constantinos A ^b  

^a UNIVERSITY OF IOANNINA   (Greece)

^b ARISTOTLE UNIVERSITY OF THESSALONIKI   (Greece)

Author keywords

[No Author keywords available]

Indexed keywords

AROMATIC COMPOUNDS; CHEMICAL SHIFT; CHEMICAL STABILITY; ELECTRONIC STRUCTURE; LIGANDS; SPECTROSCOPIC ANALYSIS;

ANTIAROMATICITY; BONDING FEATURES; ISOCYCLES; REACTION FIELDS;

RUTHENIUM COMPOUNDS;

LIGAND; METAL COMPLEX; RUTHENIUM DERIVATIVE;

ARTICLE; COMPLEX FORMATION; DENSITY FUNCTIONAL THEORY; GEOMETRY; MOLECULAR ELECTRONICS; MOLECULAR INTERACTION; NUCLEAR MAGNETIC RESONANCE SPECTROSCOPY; STRUCTURE ANALYSIS;

MAGNETIC RESONANCE SPECTROSCOPY; MODELS, CHEMICAL; MODELS, MOLECULAR; ORGANOMETALLIC COMPOUNDS; RUTHENIUM;

EID: 36149001676     PISSN: 00027863     EISSN: None     Source Type: Journal    
DOI: 10.1021/ja074094p     Document Type: Article

References (66)

1. (a) Suzuki, H.; Tanaka, Y.; Takemori, T.; Tanaka, M. J. Am. Chem. Soc. 1994, 116, 10779.
2. (b) Matsubara, K.; Okamura, R.; Tanaka, M.; Suzuki, H. J. Am. Chem. Soc. 1998, 120, 1108.
3. (c) Inagaki, A.; Takemori, T.; Tanaka, M.; Suzuki, H. Angew. Chem., Int. Ed. 2000, 39, 404.
4. (d) Ohki, Y.; Suzuki, H. Angew. Chem., Int. Ed. 2000, 39, 3463.
5. (e) Takemori, T.; Inagaki, A.; Suzuki, H. J. Am. Chem. Soc. 2001, 123, 1762.
6. (f) Suzuki, H.; Inagaki, A.; Matsubara, K.; Takemori, T. Pure Appl. Chem. 2001, 73, 315.
7. (g) Okamura, R.; Tada, K.; Matsubara, K.; Oshima, M.; Suzuki, H. Organometallics 2001, 20, 4772.
8. (h) Ohashi, M.; Matsubara, K.; Iizuka, T.; Suzuki, H. Angew. Chem., Int. Ed. 2003, 42, 937.
9. (i) Nakajima, Y.; Inagaki, A.; Suzuki, H. Organometallics 2004, 23, 4040.
10. (j) Takao, T.; Kakuta, S.; Tenjimbayashi, R.; Takemori, T.; Murotani, E.; Suzuki, H. Organometallics 2004, 23, 6090.
11. (k) Takao, T.; Takaya, Y.; Murotani, E.; Tenjimbayashi, R.; Suzuki, H. Organometallics 2004, 23, 6094.
12. (l) Nakajima, Y.; Suzuki, H. Organometallics 2005, 24, 1860.
13. (m) Takao, T.; Kawashima, T.; Matsubara, K.; Suzuki, H. Organometallics 2005, 24, 3371.
14. (n) Suzuki, H.; Kakigano, T.; Tada, K.; Igarashi, M.; Matsubara, K.; Inagaki, A.; Oshima, M.; Takao, T. Bull. Chem. Soc. Jpn. 2005, 78, 67.
15. (o) Nakajima, Y.; Hajime, H.; Suzuki, H. Angew. Chem., Int. Ed. 2006, 45, 950.
16. (a) Meister, G.; Rheinwald, G.; Stoekli-Evans, H.; Süss-Fink, G. J. Chem. Soc., Dalton Trans. 1994, 3215.
17. (b) Faure, M.; Jahncke, M.; Neels, A.; Stoekli-Evans, H.; Süss-Fink, G. Polyhedron 1999, 18, 2679.
18. (c) Faure, M.; Vallins, A. T.; Stoekli-Evans, H.; Süss-Fink, G. J. Organomet. Chem. 2001, 621, 103.
19. (d) Süss-Fink, G.; Faure, M.; Ward, T. R. Angew. Chem., Int. Ed. 2002, 41, 99.
20. (e) Vieille-Petit, L.; Vallins, A. T.; Therrien, B.; Süss-Fink, G.; Ward, T. R. J. Organomet. Chem. 2003, 684, 117.
21. (f) Süss-Fink, G.; Therrien, B.; Vieille-Petit, L.; Tschan, M.; Romakh, V. B;. Ward, T. R.; Dadras, M.; Laurenczy, G. J. Organomet. Chem. 2004, 689, 1362.
22. (g) Vieille-Petit, L.; Karmazin-Brelot, L.; Labat, G.; Süss-Fink, G. Eur. J. Inorg. Chem. 2004, 3907.
23. (h) Hagen, C. M.; Vieille-Petit, L.; Laurenczy, G.; Süss-Fink, G.; Finke, R. G. Organometallics 2005, 24, 1819 and references therein.
24. (i) Vieille-Petit, L.; Süss-Fink, G.; Therrien, B.; Ward, T. R.; Stoekli-Evans, H.; Labat, G.; Karmazin-Brelot, L.; Neels, A.; Bürgi, T.; Finke, R. G.; Hagen, C. M. Organometallics 2005, 24, 6104.
25. Tussupbayev, S.; Vyboishchikov, S. F. Organometallics 2007, 26, 56.
26. (a) Guo, R;. Balasubramanian, K. J. Chem. Phys. 2003, 118, 142.
27. (b) Zhang, W.; Zhao, H.; Wang, L. J. Phys. Chem. B 2004, 108, 2140.
28. (c) Scopelliti, S. G. R.; Severin, K. Organometallics 2005, 24, 5792.
29. (d) Deeming, A. J.; Forth, C. S.; Hyder, Md. I.; Kabir, S. F.; Nordlander, E.; Rodgers, F.; Ullmann, B. Eur. J. Inorg. Chem. 2005, 4352.
30. (a) Delgado, E.; Donnadieu, B.; Hernandez, E.; Martin, M. P.; Zamora, F. Acta Cryst. 2002, E8, m571.
31. (b) Slebodnick, C.; Zhao, J.; Angel, R.; Hanson, B. E.; Song, Y.; Liu, Z.; Hemley, R. J. Inorg. Chem. 2004, 43, 5245.
32. (c) Gervasio, G.; Bianchi, R.; Marabello, D. Chem. Phys. Lett. 2005, 407, 18.
33. (d) Griffith, C. S.; Koutsantonis, G. A.; Skelton, B. W.; White, A. H. J. Organomet. Chem. 2005, 690, 3410.
34. (e) Raithby, P. R.; Lewis, J.; Morewood, C. A.; Ramirez de Arellano M. C.; Shields, G. P. J. Cluster Sci. 2006, 17, 13.
35. (a) Boldyrev, A. I.; Wang, L.-S. Chem. Rev. 2005, 105, 3716.
36. (b) Tsipis, C. A. Coord. Chem. Rev. 2005, 249, 2740.
37. Frisch, M. J.; et al. Gaussian 03, revision B.02; Gaussian, Inc.: Pittsburgh, PA, 2003.
38. Perdew, J. P. Phys. Rev. B 1986, 33, 8822.
39. Becke, A. D. J. Chem. Phys. 1993, 98, 5648.
40. Wiberg, K. B.; Stratmann, R. E.; Frisch, M. J. Chem. Phys. Lett. 1998, 297, 60.
41. Schlegel, H. B. J. Comput. Chem., 1982, 3, 214.
42. Head-Gordon, M. P.; Frisch, M. J. Chem. Phys. Lett. 1988, 153, 503-506.
43. Reed, A. E.; Curtiss, L. A.; Weinhold, F. Chem. Rev. 1988, 88, 899.
44. Weinhold, F. In The Encyclopedia of Computational Chemistry; Schleyer, P. v. R., Ed.; John Wiley & Sons: Chichester, 1998; pp 1792-1811.
45. Gorelsky, S. I. AOMix Program for Molecular Orbital Analysis; York University: Toronto, Canada (http://www.sg-chem.net).
46. Gorelsky, S. I.; Lever, A. B. P. J. Organomet. Chem. 2001, 635, 187.
47. Ditchfield, R. Mol. Phys 1974, 27, 789-807.
48. Gauss, J. J. Chem. Phys. 1993, 99, 3629.
49. Schleyer, P. v. R.; Maerker, C.; Dransfeld, A.; Jiao, H.; Hommes, N. J. R. v. E. J. Am. Chem. Soc. 1996, 118, 6317.
50. King, R. B. Inorg. Chim. Acta 2003, 350, 126.
51. Corminboeuf, C.; Schleyer, P. v. R.; King, R. B. Chem. - Eur. J. 2007, 13, 978.
52. Parr, R. G.; Chattaraj, P. K. J. Am. Chem. Soc. 1991, 113, 1854.
53. Parr, R. G. v.; Szentpaly, L.; Liu, S. J. Am. Chem. Soc. 1999, 121, 1922.
54. (a) Stanger, A. J. Org. Chem. 2006, 71, 883.
55. (b) Stanger, A. Chem. - Eur. J. 2006, 12, 2745.
56. (a) Poater, J.; Bofill, J. M.; Alemany, P.; Solà, M. J. Org. Chem. 2006, 71, 1700.
57. (b) Jiménez-Halla, J. O. C.; Matito, E;. Robles, J.; Solà, M. J. Organometal. Chem. 2006, 691, 4359.
58. Gervasio, G.; Bianchi, R.; Marabello, D. Chem. Phys. Lett. 2005, 407, 18.
59. (a) Braunschweig, H. Angew. Chem., Int. Ed. 1998, 37, 1786 and references therein.
60. (b) Braunschweig, H.; Colling, M. J. Organometal. Chem. 2000, 614-615, 18.
61. Kuhlman, M. L.; Rauchfuss, T. B. Organometallics 2004, 23, 5085.
62. Inagaki, A.; Takaya, Y.; Takemori, T.; Suzuki, H. J. Am. Chem. Soc. 1997, 119, 625.
63. (a) Takao, T.; Inagaki, A.; Murotani, E.; Imamura, T.; Suzuki, H. Organometallics 2003, 22, 1361.
64. (b) Takao, T.; Moriya, M.; Suzuki, H. Organometallics 2007, 26, 1349.
65. (c) Moriya, M.; Takao, T.; Suzuki, H. Organometallics 2007, 26, 1650.
66. Kameo, H.; Nakajima, Y.; Suzuki, H. Eur. J. Inorg. Chem. 2007, 1793.