Synthesis, crystal structure, and high-precision high-frequency and -field electron paramagnetic resonance investigation of a manganese(III) complex: [Mn(dbm)2(py)2](ClO4)

Inorganic Chemistry

Volumn 44, Issue 2, 2005, Pages 187-196

  Aromí, Guillem ^a   Telser, Joshua ^b   Ozarowski, Andrew ^c   Brunel, Louis Claude ^c   Stoeckli Evans, Helen Margaret ^d   Krzystek, J ^c  

^a UNIVERSITY OF BARCELONA   (Spain)

^b ROOSEVELT UNIVERSITY   (United States)

^c FLORIDA STATE UNIVERSITY   (United States)

^d UNIVERSITÉ DE NEUCHÂTEL   (Switzerland)

Author keywords

[No Author keywords available]

Indexed keywords

1,3 DIPHENYL 1,3 PROPANEDIONE; ANION; DIBENZOYLMETHANE DERIVATIVE; DICHLOROMETHANE; LIGAND; MANGANESE DERIVATIVE; PYRIDINE; UNCLASSIFIED DRUG;

ARTICLE; COMPUTER PROGRAM; CRYSTAL STRUCTURE; ELECTRON SPIN RESONANCE; ENERGY; MAGNETIC FIELD; SYNTHESIS; X RAY CRYSTALLOGRAPHY;

EID: 12344321324     PISSN: 00201669     EISSN: None     Source Type: Journal    
DOI: 10.1021/ic049180u     Document Type: Article

References (54)

1. Abbreviations used: acac, anion of 2,4-pentanedione (acetylacetone); dbm, anion of 1,3-diphenyl-1,3-propanedione (dibenzoylmethane); EPR, electron paramagnetic resonance; HFEPR, high-frequency and -field EPR; INS, inelastic neutron scattering; NIR, near infrared; OEP, dianion of octaethylporphine; py, pyridine; rms, root-mean-square error; TPP, dianion of meso-tetraphenylporphine; zfs, zero-field splitting.
2. Goldberg, D. P.; Telser, J.; Krzystek, J.; Montalban, A. G.; Brunel, L.-C.; Barrett, A. G. M.; Hoffman, B. M. J. Am. Chem. Soc. 1997, 119, 8722-8723.
3. Barra, A.-L.; Gatteschi, D.; Sessoli, R.; Abbati, G. L.; Cornia, A.; Fabretti, A. C.; Uytterhoeven, M. G. Angew. Chem., Intl. Ed. Engl. 1997, 36, 2329-2331.
4. Gerritsen, H. J.; Sabisky, E. S. Phys. Rev. 1963, 132, 1507-1512.
5. Basler, R.; Tregenna-Piggott, P. L. W.; Andres, H.; Dobe, C.; Güdel, H.-U.; Janssen, S.; McIntyre, G. J. J. Am. Chem. Soc. 2001, 123, 3377-3378.
6. Krzystek, J.; Yeagle, G.; Park, J.-H.; Meisel, M. W.; Britt, R. D.; Brunel, L.-C.; Telser, J. Inorg. Chem. 2003, 42, 4610-4618.
7. Krzystek, J.; Telser, J.; Knapp, M. J.; Hendrickson, D. N.; Aromi, G.; Christou, G.; Angerhofer, A.; Brunel, L.-C. Appl. Magn. Reson. 2001, 23, 571-585.
8. Krzystek, J.; Telser, J.; Hoffman, B. M.; Brunel, L.-C.; Licoccia, S. J. Am. Chem. Soc. 2001, 123, 7890-7897.
9. Bendix, J.; Gray, H. B.; Golubkhov, G.; Gross, Z. J. Chem. Soc., Chem. Commun. 2000, 1957-1958.
10. Krzystek, J.; Telser, J.; Pardi, L. A.; Goldberg, D. P.; Hoffman, B. M.; Brunel, L.-C. Inorg. Chem. 1999, 38, 6121-6129.
11. Limburg, J.; Vrettos, J. S.; Crabtree, R. H.; Brudvig, G. W.; de Paula, J. C.; Hassan, A.; Barra, A.-L.; Duboc-Toia, C.; Collomb, M.-N. Inorg. Chem. 2001, 40, 1698-1703.
12. Mantel, C.; Hassan, A. K.; Pécaut, J.; Deronzier, A.; Collomb, M.-N.; Duboc-Toia, C. J. Am. Chem. Soc. 2003, 125, 12337-12344.
13. Mossin, S.; Weihe, H.; Barra, A.-L. J. Am. Chem. Soc. 2002, 124, 8764-8765.
14. Mossin, S.; Stefan, M.; ter Heerdt, P.; Bouwen, A.; Goovaerts, E.; Weihe, H. Appl. Magn. Reson. 2002, 21, 586.
15. Campbell, K. A.; Lashley, M. R.; Wyatt, J. K.; Nantz, M. H.; Britt, R. D. J. Am. Chem. Soc. 2001, 123, 5710-5719.
16. Krzystek, J.; Telser, J. J. Magn. Reson. 2003, 162, 454-465.
17. Krzystek, J.; Pardi, L. A.; Brunel, L.-C.; Goldberg, D. P.; Hoffman, B. M.; Licoccia, S.; Telser, J. Spectrochim. Acta, Part A 2002, 58, 1113-1127.
18. + salt should be dried in vacuo at room temperature.
19. Vincent, J. B.; Folting, K.; Huffman, J. C.; Christou, G. Inorg. Chem. 1996, 25, 996-999.
20. Sheldrick, G. M. Acta Crystallogr. 1990, A46, 467-473.
21. Sheldrick, G. SHELXL; University of Göttingen: Göttingen, Germany, 1999.
22. Hassan, A. K.; Pardi, L. A.; Krzystek, J.; Sienkiewicz, A.; Goy, P.; Rohrer, M.; Brunel, L.-C. J. Magn. Reson. 2000, 142, 300-312.
23. Pardi, L. A.; Krzystek, J.; Telser, J.; Brunel, L.-C. J. Magn. Reson. 2000, 146, 375-378.
24. Abragam, A.; Bleaney, B. Electron Paramagnetic Resonance of Transition Ions; Dover Publications: New York, 1986.
25. 0.
26. McGavin, D. G.; Tennant. W. C.; Weil, J. A. J. Magn. Reson. 1990, 87, 92-109.
27. Bencini, A.; Gatteschi, D. In Transition Metal Chemistry; Melson, G. A., Figgis, B. N., Eds.; Marcel Dekker: New York, 1982; Vol. 8, p 1.
28. Press: W. H.; Flannery, B. P.; Teukolsky, A. A.; Vetterling, W. T. In Numerical Recipes in Pascal; Cambridge University Press: Cambridge, U.K., 1989; p 572.
29. Wilkinson, J. H. The Algebraic Eigenvalue Problem; Clarendon Press: London, 1970.
30. Aromí, G.; Aubin, S. M. J.; Bolcar, M. A.; Christou, G.; Eppley, H. J.; Folting, K.; Hendrickson, D. N.; Huffman, J. C.; Squire, R. C.; Tsai, H. L.; Wang, S.; Wemple, M. W. Polyhedron 1998, 17, 3005-3020.
31. Aromí, G.; Knapp, M. J.; Claude, J. P.; Huffman, J. C.; Hendrickson, D. N.; Christou, G. J. Am. Chem. Soc. 1999, 121, 5489-5499.
32. Wang, S.; Wemple, M. S.; Yoo, J.; Folting, K.; Huffman, J. C.; Hagen, K. S.; Hendrickson, D. N.; Christou, G. Inorg. Chem. 2000, 39, 1501-1513.
33. Lynch, M. W.; Hendrickson, D. N.; Fitzgerald, B. J.; Pierpont, C. G. J. Am. Chem. Soc. 1984, 106, 2041-2049.
34. Attia, A. S.; Pierpont, C. G. Inorg. Chem. 1995, 34, 1172-1179.
35. Shongwe, M. S.; Vandayar, S. K.; Fernandes, M. A.; Marques, H. M.; Morris, M. J.; Heath, S. L. Polyhedron 2001, 20, 2195-2201.
36. Nakamura, T.; Niwa, K.; Usugi, S.; Asada, H.; Fujiwara, M.; Matsushita, T. Polyhedron 2001, 20, 191-201.
37. Bermejo, M. R.; Deibe, A. G.; Rey, M.; Sanmartin, J.; Sousa, A.; Aurangzeb, N.; Hulme, C. E.; McAuliffe, C. A.; Pritchard, R. G.; Watkinson, M.; Helliwell, M. J. Chem. Soc., Dalton Trans. 1994, 1265-1269.
38. Aromí, G.; Gamez, P.; Roubeau, O.; Berzal, P. C.; Kooijman, H.; Spek, A. L.; Driessen, W. L.; Reedijk, J. Inorg. Chem. 2002, 41, 3673-3683.
39. 55Mn, in concurrence with all other HFEPR studies of Mn(III) molecular complexes known to us.
40. Krzystek, J.; Park, J.-H.; Meisel, M. W.; Hitchman, M. A.; Stratemeier, H.; Brunei, L.-C.; Telser, J. Inorg. Chem. 2002, 41, 4478-4487.
41. Krzystek, J.; Fiedler, A. T.; Sokol, J. J.; Ozarowski, A.; Zvyagin, S. A.; Brunold, T. C.; Long, J. R.; Brunel, L.-C.; Telser, J. Inorg. Chem. 2004, 43, 5645-5658.
42. Krzystek, J.; Zvyagin, S. A.; Ozarowski, A.; Fiedler, A. T.; Brunold, T. C.; Telser, J. J. Am. Chem. Soc. 2004, 126, 2148-2155.
43. Tregenna-Piggott, P. L. W.; Weihe, H.; Barra, A.-L. Inorg. Chem. 2003, 42, 8504-8508.
44. Barra, A.-L.; Brunel, L.-C.; Gatteschi, D.; Pardi, L.; Sessoli, R. Acc. Chem. Res. 1998, 31, 460-466.
45. Ozarowski, A.; Zvyagin, S. A.; Reiff, W. M.; Telser, J.; Brunel, L. C.; Krzystek, J. J. Am. Chem. Soc. 2004, 126, 6574-6575.
46. Tregenna-Piggott, P. L. W.; Weihe, H.; Bendix, J.; Barra, A.-L.; Güdel, H.-U. Inorg. Chem. 1999, 38, 5928-5929.
47. -1 16 but still a rigorously axial zfs tensor.
48. An exception is found for Mn(III) as a dopant in rutile, but this is not a molecular complex.
49. Tregenna-Piggott, P. L. W.; Andres, H.-P.; McIntyre, G. J.; Best, S. P.; Wilson, C. C.; Cowan, J. A. Inorg. Chem. 2003, 42, 1350-1365.
50. Schäffer, C. E. Struct. Bonding 1968, 5, 68-95.
51. Davis, T. S.; Fackler, J. P., Jr.; Weeks, M. J. Inorg. Chem. 1968, 7, 1994-2002.
52. Ballhausen, C. J. In Introduction to Ligand Field Theory; McGraw-Hill: New York, 1962; pp 99-103.
53. Schäffer, C. E.; Yamatera, H. Inorg. Chem. 1991, 30, 2840-2853.
54. Ceulemans, A.; Dendooven, M.; Vanquickenborne, L. G. Inorg. Chem. 1985, 24, 1153-1158.