Structures and unusual rearrangements of coordination adducts of MX 5 (M = Nb, Ta; X = F, Cl) with simple diethers. a crystallographic, spectroscopic, and computational study

Inorganic Chemistry

Volumn 49, Issue 1, 2010, Pages 339-351

  Bini, Riccardo ^a   Chiappe, Cinzia ^b   Marchetti, Fabio ^b   Pampaloni, Guido ^b   Zacchini, Stefano ^c  

^a UNIVERSITY OF FLORENCE   (Italy)

^b UNIVERSITY OF PISA   (Italy)

^c UNIVERSITY OF BOLOGNA   (Italy)

Author keywords

[No Author keywords available]

Indexed keywords

EID: 73349137358     PISSN: 00201669     EISSN: None     Source Type: Journal    
DOI: 10.1021/ic9020806     Document Type: Article

References (99)

1. (a) Kissin, Y. V.; Liu, X.; Pollick, D. J.; Brungard, N. L.; Chang, M. J. Mol. Catai. A: Chem. 2008, 287, 45.
2. (b) Zhang, W.; Sita, L. R. Adv. Synth. Catai. 2008, 350, 439.
3. (c) Fink, G.; Brintzinger, H.-H. Polymerization Reactions. In Metal Catalysis in Industrial Organic Processes; Chiusoli, G. P., Maitlis, P. M., Eds.; RSC Publishing: London, 2006; Chapter 7, p 219.
4. (d) Erker, G.; Kehr, G.; Fröhlich, R. J. Organomet. Chem. 2005, 690, 6254.
5. (e) Corradini, P.; Guerra, G.; Cavallo, L. Acc. Chem. Res. 2004, 37, 231.
6. (f) Coates, G. W. J. Chem. Soc., Dalton Trans. 2002, 467.
7. (g) Imanishi, Y.; Naga, N. Prog. Polym. Sci. 2001, 26, 1147.
8. (a)Corma, A.; Garcia, H. Chem. Rev. 2003, 103, 4307.
9. (b) Lewis acids and selectivity in organic synthesis; Santelli, M., Pons, J.-M., Eds.; CRC Press: Boca Raton, FL, 1995.
10. (c) Lewis Acids in Organic Synthesis; Yamamoto, H., Ed.; Wiley-VCH: Weinheim, Germany, 2000; Vol. 2.
11. Some recent references are as follows:(a) Rodríguez-Cisterna, V.; Villar, C.; Romea, P.; Urpi, F. J. Org. Chem. 2007, 72, 6631.
12. (b) Mamat, C.; Büttner, S.; Trabhardt, T.; Fischer, C.; Langer, P. J. Org. Chem. 2007, 72, 6273.
13. (c) Basavaiah, D.; Reddy, K. R. Org. Lett. 2007, 9, 57.
14. (d) Nguyen, V. T. H.; Bellur, E.; Appel, B.; Langer, P. Synthesis 2006, 1103.
15. (e) Anastasia, L.; Giannini, E.; Zanoni, G.; Vidari, G. Tetrahedron Lett. 2005, 46, 5803.
16. Smitha, G.; Chandrasekhar, S.; Reddy, C. S. Synthesis 2008, 829 and references cited therein.
17. (a) Hayashi, Y.; Nakamura, M.; Nakao, S.; Inoue, T.; Shoji, M. Angew. Chem., Int. Ed. 2002, 41, 4079.
18. (b) Shoji, M.; Yamaguchi, J.; Kakeya, H.; Osada, H.; Hayashi, Y. Angew. Chem., Int. Ed. 2002, 41, 3192.
19. (a) Düz, B.; Elbistan, C. K.; Ece, A.; Sevin, F. Appl. Organomet. Chem. 2009, 23, 359.
20. (b) Goswami, S.; Maity, A. C. Tetrahedron Lett. 2008, 49, 3092.
21. (c) Waldvogel, S. R. Synlett 2002, 622.
22. (d) Kramer, B.; Fröhlich, R.; Bergander, K.; Waldvogel, S. R. Synthesis 2003, 91.
23. (e) Guo, Q.; Miyaji, T.; Hara, R.; Shen, B.; Takahashi, T. Tetrahedron 2002, 58, 7327.
24. 5.
25. Raspolli Galletti, A. M.; Pampaloni, G. Coord. Chem. Rev., doi:10.1016/j.ccr.2009.07.026.
26. Fathi, M. H.; Mortazavi, V. Dental Res. J. 2007, 4, 74.
27. Velten, D.; Eisenbarth, E.; Schanne, N.; Breme, J. J. Mater. Sci., Mater. Med. 2004, 15, 457.
28. Matsuno, H.; Yokoyama, A.; Watari, F.; Uo, M.; Kawasaki, T. Biomaterials 2001, 22, 1253.
29. Mallela, V. S.; Ilankumaran, V.; Rao, N. S. Indian Pacing Electrophysiol. J. 2004, 4, 201.
30. (a) de Oliveira, R. N.; de Melo, A. C. N.; Srivastava, R. M.; Sinou, D. Heterocycles 2006, 68, 2607.
31. (b) Kleber, C.; Andrade, Z.; Matos, R. A. F. Synlett 2003, 1189.
32. (c) Chandrasekhar, S.; Mohanty, P. K.; Raza, A. Synth. Commun. 1999, 29, 257.
33. (d) Chandrasekhar, S.; Prakash, S. J.; Jagadeshwar, V.; Narsihmulu, Ch. Tetrahedron Lett. 2001, 42, 5561 and references cited therein.
34. (e) Solari, E.; Floriani, C.; Chiesi-Villa, A.; Rizzoli, C. J. Chem. Soc., Chem. Commun. 1991, 841.
35. (f) Oh, K.; Knabe, W. E. Tetrahedron 2009, 65, 2966.
36. (g) Kirihara, M.; Yamamoto, J.; Noguchi, T.; Hirai, Y. Tetrahedron Lett. 2009, 50, 1180.
37. (h) Jadav, J. S.; Ganganna, B.; Bhunia, D. C.; Srihari, P. Tetrahedron Lett. 2009, 50, 4318.
38. (i) Gao, S.-T.; Liu, W.-H.; Ma, J.-J.; Wang, C.; Liang, Q. Synth. Commun. 2009, 39, 3278.
39. (j) Driver, T. G. Angew. Chem., Int. Ed. 2009, 48, 7974.
40. Maeta, H.; Nagasawa, T.; Handa, Y.; Takei, T.; Osamura, Y.; Suzuki, K. Tetrahedron Lett. 1995, 36, 899.
41. (a) Petrov, V. A. Synthesis 2002, 2225.
42. (b) Kim, S. S.; Rajagopal, G.; George, S. C. Appl. Organomet. Chem. 2007, 21, 368.
43. (a) Häussler, M.; Qin, A.; Tang, B. Z. Polymer 2007, 48, 6181.
44. (b) Zheng, R.; Häussler, M.; Dong, H.; Lam, J. W. Y.; Tang, B. Z. Macromolecules 2006, 39, 7973.
45. (c) Zheng, R.; Dong, H.; Peng, H.; Lam, J. W. Y.; Tang, B. Z. Macromolecules 2004, 37, 5196.
46. Calderazzo, F.; Pallavicini, P.; Pampaloni, G.; Zanazzi, P. F. J. Chem. Soc., Dalton Trans. 1990, 2743.
47. Marchetti, F.; Pampaloni, G.; Zacchini, S. Dalton Trans. 2007, 4343.
48. (a) Marchetti, F.; Pampaloni, G.; Zacchini, S. Inorg. Chem. 2008, 47, 365.
49. (b) Marchetti, F.; Pampaloni, G.; Zacchini, S. Polyhedron 2008, 27, 1969.
50. (c) Marchetti, F.; Pampaloni, G.; Zacchini, S. Dalton Trans. 2008, 7026.
51. Marchetti, F.; Pampaloni, G.; Zacchini, S. Dalton Trans. 2009, 6759.
52. Marchetti, F.; Pampaloni, G.; Zacchini, S. Dalton Trans. 2009, 8096.
53. Marchetti, F.; Pampaloni, G.; Zacchini, S. Chem. Commun. 2008, 3651.
54. (a) Jutand, A. Eur. J. Inorg. Chem. 2003, 2017.
55. (b) Geary, W. J. Coord. Chem. Rev. 1971, 7, 81.
56. Sheldrick, G. M. SHELX97-Program for the refinement of Crystal Structures; University of Göttingen: Göttingen, Germany, 1997.
57. 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, H.; 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. 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. Gaussian03,revision A.l; Gaussian, Inc.: Pittsburgh, PA, 2003.
58. (a) Parr, R. G.; Yang, W. Density-Functional Theory of Atoms and Molecules; Oxford University Press: Oxford, U.K., 1989.
59. (b) Becke, A. D. J. Chem. Phys. 1992, 96, 2155.
60. (c) Perdew, J. P.; Chevary, J. A.; Vosko, S. H.; Jackson, K. A.; Pederson, M. R.; Singh, D. J.; Fiolhais, C. Phys. Rev. B 1992, 46, 6671.
61. (a) Wadt, W. R.; Hay, P. J. J. Chem. Phys. 1985, 82, 284.
62. (b) Hay, P. J.; Wadt, W. R. J. Chem. Phys. 1985, 82, 299.
63. Glendening, E. D.; Reed, A. E.; Carpenter, J. E.; Weinhold, F. NBO, version 3.1, University of Wisconsin: Madison, WI, 1993.
64. See, for example:(a) Schweiger, K.; Hückstädt, H.; Homborg, H. Z. Anorg. Allg. Chem. 1997, 623, 1853.
65. (b) Drew, M. G. B.; Wolters, A. P.; Wilkins, J. D. Acta Crystallogr., Sect. B 1975, 31, 324.
66. (c) Dewan, J. C.; Kepert, D. L.; Raston, C. L.; White, A. H. J. Chem. Soc., Dalton Trans. 1975, 2031.
67. (d) Cotton, F. A.; Falvello, L. R.; Najjar, R. C. Inorg. Chem. 1983, 22, 770.
68. (e) Kepert, D. L.; Skelton, B. W.; White, A. H. J. Chem. Soc., Dalton Trans. 1981, 652.
69. (f) McKams, P. J.; Heeg, M. J.; Winter, C. H. Inorg. Chem. 1998, 37, 4743.
70. Knopp, P.; Wieghardt, K.; Nuber, B.; Weiss, J. Z. Naturforsch. 1991, 46B, 1077.
71. Jura, M.; Levason, W.; Reid, G.; Webster, M. Dalton Trans. 2009, 7610.
72. Hoard, J. L.; Martin, W. J.; Smith, M. E.; Whitney, J. F. J. Am. Chem. Soc. 1954, 76, 3820.
73. Marchetti, F.; Pampaloni, G.; Zacchini, S. J. Fluorine Chem., doi:10.1016/j.jfluchem.2009.09.014.
74. Brownstein, S. Inorg. Chem. 1973, 12, 584.
75. Packer, K. J.; Muetterties, E. L. J. Am. Chem. Soc. 1963, 85, 3035.
76. Aksnes, D. W.; Hutchinson, S. M.; Packer, K. J. Mol. Phys. 1968, 14, 301.
77. Zahlenwerte und Funktionen aus Physik, Chemie, Astronomie, Geophysic und Technik, 6th ed.; Landolt-Börnstein Series; Springer Verlag: Berlin, 1969; Vol. 2.
78. CRC Handbook of Chemistry and Physics; CRC Press: Boca Raton, FL, 1996.
79. - anions may coexist as counterions: however, we believe that the nature of the anion does not influence the thermal modification of the O-donor ligand within the cationic unit.
80. Marchetti, F.; Pampaloni, G.; Zacchini, S. Polyhedron 2009, 28, 1235.
81. (a) Evans, W. J.; Ulibarri, T. A.; Ziller, J. W. Organometallics 1991, 10, 134.
82. (b) Eabom, C.; Hitchcock, P. B.; Izod, K.; Smith, J. D. J. Am. Chem. Soc. 1994, 116, 12071.
83. (c) Deelman, B.-J.; Booij, M.; Meetsma, A.; Teuben, J. H.; Kooijman, H.; Spek, A. L. Organometallics 1995, 14, 2306.
84. (d) Takaki, K.; Maruo, M.; Kamata, T. J. Org. Chem. 1996, 61, 8332.
85. (e) Duncalf, D. J.; Hitchcock, P. B.; Lawless, G. A. Chem. Commun. 1996, 269.
86. (f) Cassani, M. C.; Lappert, M.F.; Laschi, F. Chem. Commun. 1997, 1563.
87. (g) Bradley, C. A.; Veiros, L. F.; Pun, D.; Lobkovsky, E.; Keresztes, I.; Chirik, P. J. J. Am. Chem. Soc. 2006, 128, 16600.
88. (h) La Caër, S.; Mestdagh, H.; Schroeder, D.; Zummack, W.; Schwarz, H. Int. J. Mass Spectrom. 2006, 255-256, 239.
89. (i) Fedushkin, I. L.; Lukoyanov, A. N.; Hummert, M.; Schumann, H. Z. Anorg. Allg. Chem. 2008, 634, 357.
90. (a) Gun'ko, Y. K.; Hitchcock, P. B.; Lappert, M. F. J. Organomet. Chem. 1995, 499, 213.
91. (b) Cassani, M. C.; Gun'ko, Y. K.; Hitchcock, P. B.; Hulkes, A. G.; Khvostov, A. V.; Lappert, M. F.; Protchenko, A. V. J. Organomet. Chem. 2002, 647, 71.
92. (c) Le Caer, S.; Heninger, M.; Lemaire, J.; Boissel, P.; Matre, P.; Mestdagh, H. Chem. Phys. Lett. 2004, 385, 273.
93. (d) Le Caër, S.; Heninger, M.; Pemot, P.; Mestdagh, H. J. Phys. Chem. A 2006, 110, 9654.
94. (e) Bradley, C. A.; Veiros, L. F.; Chirik, P. J. Organometallics 2007, 26, 3191.
95. (f) Fedushkin, I. L.; Girgsdies, F.; Schumann, H.; Bochkarev, M. N. Eur. J. Inorg. Chem. 2001, 2405.
96. Delaney, P. A.; Johnstone, R. A. W.; Entwistle, I. D. J. Chem. Soc., Perkin Trans. 1 1986, 1855.
97. (a) Noble, A. M.; Winfield, J. M. Inorg. Nucl. Chem. Lett. 1968, 4, 339.
98. (b) Darragh, J. I.; Noble, A. M.; Sharp, D. W. A.; Winfield, J. M. J. Inorg. Nucl. Chem. 1970, 32, 1745.
99. -1