Spectroscopic evidence for redox isomerism in the 1,4-diethynylbenzene- bridged heterobimetallic cation [{Fe(dppe)Cp*}(μ-C≡CC 6H4C≡C){Mo(dppe)(η-C7H 7)}]PF6

Organometallics

Volumn 30, Issue 15, 2011, Pages 4180-4195

  Fitzgerald, Emma C ^a,b   Ladjarafi, Abdelkader ^b,c   Brown, Neil J ^d   Collison, David ^a   Costuas, Karine ^b   Edge, Ruth ^a   Halet, Jean François ^b   Justaud, Frédéric ^b   Low, Paul J ^d   Meghezzi, Hacène ^c   Roisnel, Thierry ^b   Whiteley, Mark W ^a   Lapinte, Claude ^b  

^a UNIVERSITY OF MANCHESTER   (United Kingdom)

^b INSTITUT DES SCIENCES CHIMIQUES DE RENNES   (France)

^c UNIVERSITY OF SCIENCES AND TECHNOLOGY HOUARI BOUMEDIENE   (Algeria)

^d DURHAM UNIVERSITY   (United Kingdom)

Author keywords

[No Author keywords available]

Indexed keywords

ALKYNYLS; BRIDGING LIGANDS; CHEMICAL OXIDATION; DIETHYNYLBENZENE; EPR SPECTRA; EPR SPECTROSCOPY; EQUILIBRIUM MIXTURES; EXPERIMENTAL INVESTIGATIONS; FRONTIER ORBITALS; FROZEN SOLUTIONS; HETEROBIMETALLICS; IR SPECTRUM; IRON CENTERS; ISOMERIC FORMS; ONE-ELECTRON OXIDATION; PROTON MIGRATION; REDOX ISOMERS; SHORT TIME SCALE; SPECTROSCOPIC EVIDENCE; SPECTROSCOPIC SIGNATURES; SPIN DENSITIES; VOLTAMMETRIC INVESTIGATION;

ELECTRON SPIN RESONANCE SPECTROSCOPY; ISOMERS; LIGANDS; METALLIC COMPOUNDS; METHANOL; OXIDATION; PARAMAGNETISM; SPECTROSCOPY; STEREOCHEMISTRY;

MOLYBDENUM;

EID: 79961097219     PISSN: 02767333     EISSN: 15206041     Source Type: Journal    
DOI: 10.1021/om200488b     Document Type: Article

References (76)

1. Paul, F.; Lapinte, C. Coord. Chem. Rev. 1998, 178-180, 431
2. Bruce, M. I.; Low, P. J. Adv. Organomet. Chem. 2004, 50, 179
3. Carroll, R. L.; Gorman, C. B. Angew. Chem., Int. Ed. 2002, 41, 4378
4. Low, P. J. Dalton Trans. 2005, 2821
5. Qi, H.; Gupta, A.; Noll, B. C.; Snider, G. L.; Lu, Y.; Lent, C.; Fehlner, T. P. J. Am. Chem. Soc. 2005, 127, 15218
6. Samoc, M.; Gauthier, N.; Cifuentes, M. P.; Paul, F.; Lapinte, C.; Humphrey, M. G. Angew. Chem., Int. Ed. 2006, 45, 7376
7. Tanaka, Y.; Ishisaka, T.; Inagaki, A.; Koike, T.; Lapinte, C.; Akita, M. Chem. - Eur. J. 2010, 16, 4762
8. Le Narvor, N.; Toupet, L.; Lapinte, C. J. Am. Chem. Soc. 1995, 117, 7129
9. Guillemot, M.; Toupet, L.; Lapinte, C. Organometallics 1998, 17, 1928
10. Brady, M.; Weng, W.; Zhou, Y.; Seyler, J. W.; Amoroso, A. J.; Arif, A. M.; Böhme, M.; Frenking, G.; Gladysz, J. A. J. Am. Chem. Soc. 1997, 119, 775
11. Bruce, M. I.; Low, P. J.; Costuas, K.; Halet, J.-F.; Best, S. P.; Heath, G. A. J. Am. Chem. Soc. 2000, 122, 1949
12. Bruce, M. I.; Ellis, B. G.; Low, P. J.; Skelton, B. W.; White, A. H. Organometallics 2003, 22, 3184
13. Semenov, S. N.; Blacque, O.; Fox, T.; Venkatesan, K.; Berke, H. J. Am. Chem. Soc. 2010, 132, 3115
14. Kheradmandan, S.; Heinze, K.; Schmalle, H. W.; Berke, H. Angew. Chem., Int. Ed. 1999, 38, 2270
15. Lavastre, O; Plass, J.; Bachmann, P.; Guesmi, S.; Moinet, C.; Dixneuf, P. H. Organometallics 1997, 16, 184
16. Rigaut, S.; Olivier, C.; Costuas, K.; Choua, S.; Fadhel, O.; Massue, J.; Turek, P.; Saillard, J.-Y.; Dixneuf, P. H.; Touchard, D. J. Am. Chem. Soc. 2006, 128, 5859
17. Klein, A.; Lavastre, O.; Fiedler, J. Organometallics 2006, 25, 635
18. Weyland, T.; Lapinte, C.; Frapper, G.; Calhorda, M. J.; Halet, J.-F.; Toupet, L. Organometallics 1997, 16, 2024
19. Weyland, T.; Costuas, K.; Mari, A.; Halet, J.-F.; Lapinte, C. Organometallics 1998, 17, 5569
20. Weyland, T.; Costuas, K.; Toupet, L.; Halet, J.-F.; Lapinte, C. Organometallics 2000, 19, 4228
21. Fox, M. A.; Farmer, J. D.; Roberts, R. L.; Humphrey, M. G.; Low, P. J. Organometallics 2009, 28, 5266
22. Le Narvor, N.; Lapinte, C. Organometallics 1995, 14, 634
23. Paul, F.; Bondon, A.; da Costa, G.; Malvolti, F.; Sinbandhit, S.; Cador, O.; Costuas, K.; Toupet, L.; Boillot, M.-L. Inorg. Chem. 2009, 48, 10608
24. Bruce, M. I.; Hall, B. C.; Kelly, B. D.; Low, P. J.; Skelton, B. W.; White, A. H. J. Chem. Soc., Dalton Trans. 1999, 3719
25. Armitt, D. J.; Bruce, M. I.; Gaudio, M.; Zaitseva, N. N.; Skelton, B. W.; White, A. H.; Le Guennic, B.; Halet, J.-F.; Fox, M. A.; Roberts, R. L.; Hartl, F.; Low, P. J. Dalton Trans 2008, 6763
26. Field, L. D.; George, A. V.; Laschi, F.; Malouf, E. Y.; Zanello, P. J. Organomet. Chem. 1992, 435, 347
27. Jiao, H.; Costuas, K.; Gladysz, J. A.; Halet, J.-F.; Guillemot, M.; Toupet, L.; Paul, F.; Lapinte, C. J. Am. Chem. Soc. 2003, 125, 9511
28. Bruce, M. I.; Costuas, K.; Davin, T.; Ellis, B. G.; Halet, J.-F.; Lapinte, C.; Low, P. J.; Smith, M. E.; Skelton, B. W.; Toupet, L.; White, A. H. Organometallics 2005, 24, 3864
29. Paul, F.; Meyer, W. E.; Toupet, L.; Jiao, H.; Gladysz, J. A.; Lapinte, C. J. Am. Chem. Soc. 2000, 122, 9405
30. Gauthier, N.; Olivier, C.; Rigaut, S.; Touchard, D.; Roisnel, T.; Humphrey, M. G.; Paul, F. Organometallics 2008, 27, 1063
31. Wong, K. M.-C.; Lam, S. C.-F.; Ko, C.-C.; Zhu, N.; Yam, V.W.-W.; Roué, S.; Lapinte, C.; Fathallah, S.; Costuas, K.; Kahlal, S.; Halet, J.-F. Inorg. Chem. 2003, 42, 7086
32. Brown, N. J.; Lancashire, H. N.; Fox, M. A.; Collison, D.; Edge, R.; Yufit, D. S.; Howard, J. A. K.; Whiteley, M. W.; Low, P. J. Organometallics 2011, 30, 884
33. Brown, N. J.; Collison, D.; Edge, R.; Fitzgerald, E. C.; Helliwell, M.; Howard, J. K.; Lancashire, H. N.; Low, P. J.; McDouall, J. J. W.; Raftery, J.; Smith, C. A.; Yufit, D. S.; Whiteley, M. W. Organometallics 2010, 29, 1261
34. Courmarcel, J.; Le Gland, G.; Toupet, L.; Paul, F.; Lapinte, C J. Organomet. Chem. 2003, 670, 108
35. Grime, R. W.; Helliwell, M.; Hussain, Z. I.; Lancashire, H. N.; Mason, C. R.; McDouall, J. J. W.; Mydlowski, C. M.; Whiteley, M. W. Organometallics 2008, 27, 857
36. Bartlett, M. J.; Hill, A. F.; Smith, M. K. Organometallics 2005, 24, 5795
37. Denis, R.; Toupet, L.; Paul, F.; Lapinte, C. Organometallics 2000, 19, 4240
38. Brown, N. J.; Collison, D.; Edge, R.; Fitzgerald, E. C.; Roberts, H. N.; Tuna, F.; Low, P. J.; Whiteley, M. W., unpublished work.
39. Connelly, N. G.; Geiger, W. E. Chem. Rev. 1996, 96, 877
40. Bitcon, C.; Whiteley, M. W. J. Organomet. Chem. 1987, 336, 385
41. Tamm, M; Kunst, A.; Bannenberg, T.; Herdtweck, E.; Schmid, R. Organometallics 2005, 24, 3163
42. Menconi, G.; Kaltsoyannis, N. Organometallics 2005, 24, 1189
43. Li, J.; Bursten, B. E. J. Am. Chem. Soc. 1997, 119, 9021
44. Costuas, K.; Cador, O.; Evangelisli, S.; Justaud, F.; Le Stang, S.; Monari, A.; Paul, F.; Toupet, L.; Lapinte, C.; Halet, J.-F., manuscript in preparation.
45. Cohen, A. J.; Mori-Sánchez, P.; Yang, W. Science 2008, 321, 792
46. Renz, M.; Theilacker, K.; Lambert, C.; Kaupp, M. J. Am. Chem. Soc. 2009, 131, 16292
47. Paul, F.; Mevellec, J.-Y.; Lapinte, C. J. Chem. Soc., Dalton Trans. 2002, 1783
48. Coat, F.; Paul, F.; Lapinte, C.; Toupet, L.; Costuas, K.; Halet, J.-F. J. Organomet. Chem. 2003, 683, 368
49. Dei, A.; Sorace, L. Appl. Magn. Reson. 2010, 38, 139
50. Aston, G. M.; Badriya, S.; Farley, R. D.; Grime, R. W.; Ledger, S. J.; Mabbs, F. E.; McInnes, E. J. L.; Morris, H.; Ricalton, A.; Rowlands, C. C.; Wagner, K.; Whiteley, M. W. J. Chem. Soc., Dalton Trans. 1999, 4379
51. Brown, N. J.; Collison, D.; Edge, R.; Fitzgerald, E. C.; Low, P. J.; Helliwell, M.; Ta, Y. T.; Whiteley, M. W. Chem. Commun. 2010, 46, 2253
52. Carter, E.; Collison, D.; Edge, R.; Fitzgerald, E. C.; Lancashire, H. N.; Murphy, D. M.; McDouall, J. J. W.; Sharples, J.; Whiteley, M. W. Dalton Trans. 2010, 39, 11424
53. Connelly, N. G.; Gamasa, M. P.; Gimeno, J.; Lapinte, C.; Lastra, E.; Maher, J. P.; Le Narvor, N; Rieger, A. L.; Rieger, P. H. J. Chem. Soc., Dalton Trans. 1993, 2575
54. Paul, F.; Toupet, L.; Thépot, J.-Y.; Costuas, K.; Halet, J.-F.; Lapinte, C. Organometallics 2005, 24, 5464
55. Ghazala, S. I.; Paul, F.; Toupet, L.; Roisnel, T.; Hapiot, P; Lapinte, C. J. Am. Chem. Soc. 2006, 128, 2463
56. Coat, F.; Guillevic, M.-A.; Toupet, L.; Paul, F.; Lapinte, C. Organometallics 1997, 16, 5988
57. Demadis, K. D.; Hartshorn, C. M.; Meyer, T. J. Chem. Rev. 2001, 101, 2655
58. Brunschwig, B. S.; Creutz, C.; Sutin, N. Chem. Soc. Rev. 2002, 31, 168
59. D'Alessandro, D. M; Keene, F. R. Chem. Soc. Rev. 2006, 35, 424
60. Roger, C.; Hamon, P.; Toupet, L.; Rabaǎ, H.; Saillard, J.-Y.; Hamon, J.-R.; Lapinte, C. Organometallics 1991, 10, 1045
61. Krejeik, M.; Danek, M.; Hartl, F. J. Electroanal. Chem. 1991, 317, 179
62. Varret, F.; Mariot, J.-P.; Hamon, J.-R.; Astruc, D. Hyperfine Interact. 1988, 39, 67
63. Altomare, A.; Burla, M. C.; Camalli, M.; Cascarano, G. L.; Giacovazzo, C.; Guagliardi, A.; Moliterni, A. A. G.; Polidori, G.; Spagna, R. J. Appl. Crystallogr. 1999, 32, 115
64. Sheldrick, G. M. SHELXL-97, Program for Crystal Structure Refinement; Universität Göttingen: Germany, 1997.
65. Sheldrick, G. M. Acta Crystallogr. 2008, A64, 112
66. Frisch, M. J.; Gaussian 03 Revision C02; Gaussian, Inc.: Wallingford, CT, 2004.
67. Mielich, B.; Savin, A.; Stoll, H.; Preuss, H. Chem. Phys. Lett. 1989, 157, 200
68. Lee, C.; Yang, W.; Parr, R. G. Phys. Rev. B 1988, 37, 785
69. Becke, A. D. J. Chem. Phys. 1993, 98, 5648
70. Hay, P. J.; Wadt, W. R. J. Chem. Phys. 1985, 82, 270
71. Noodleman, L.; Norman, J. G., Jr. J. Chem. Phys. 1979, 70, 4903
72. Noodleman, L. J. Chem. Phys. 1981, 74, 5737
73. Jaguar 6.0; Schrodinger, LLC: New York, 2005.
74. Gorelsky, S. I.; Lever, A. B. P. J. Organomet. Chem. 2001, 635, 187
75. Gorelsky, S. I. AOMix program, Program for Molecular Orbital Analysis, Rev. 6.42; University of Ottawa: Ottawa, Canada, 2009, (http://www.sg-chem.net/ aomix).
76. Flükiger, P.; Lüthi, H. P.; Portmann, S.; Weber, J. Molekel 4.3; Swiss Center for Scientific Computing: Manno, Switzerland, 2000-2002, (http://www.cscs.ch/molkel).