Novel carbonyl iron-bismuth clusters - Synthesis, structure, CO2 insertion and potential as molecular precursors for BiFeO3

Journal of Organometallic Chemistry

Volumn 696, Issue 8, 2011, Pages 1647-1651

  Wójcik, Katarzyna ^a   Rüffer, Tobias ^a   Lang, Heinrich ^a   Auer, Alexander A ^b   Mehring, Michael ^a  

^a CHEMNITZ UNIVERSITY OF TECHNOLOGY   (Germany)

^b MAX PLANCK INSTITUT FÜR EISENFORSCHUNG GMBH   (Germany)

Author keywords

BiFeO3; Bismuth alkoxide; Bismuth cluster; CO 2 insertion; Iron carbonyl

Indexed keywords

BIFEO3; CARBONYL IRON; CLUSTER CORES; CO 2 INSERTION; CORE STRUCTURE; H NMR SPECTROSCOPY; IRON CARBONYL; IRON CLUSTER; MOLECULAR PRECURSOR; MULTIFERROICS; SINGLE CRYSTAL X-RAY DIFFRACTION; STARTING MATERIALS;

BISMUTH; CARBONYLATION; CRYSTAL IMPURITIES; IRON OXIDES; NUCLEAR MAGNETIC RESONANCE SPECTROSCOPY; SINGLE CRYSTALS; SYNTHESIS (CHEMICAL); THERMOGRAVIMETRIC ANALYSIS; X RAY DIFFRACTION;

BISMUTH COMPOUNDS;

EID: 79953652356     PISSN: 0022328X     EISSN: None     Source Type: Journal    
DOI: 10.1016/j.jorganchem.2011.01.028     Document Type: Article

References (50)

1. J. Wang, J.B. Neaton, H. Zheng, V. Nagarajan, S.B. Ogale, B. Liu, D. Viehland, V. Vaithyanathan, D.G. Schlom, U.V. Waghmare, N.A. Spaldin, K.M. Rabe, M. Wuttig, and R. Ramesh Science 299 2003 1719
2. G. Catalan, and J.F. Scott Adv. Mater. 21 2009 2463
3. M.K. Singh, Y. Yang, and C.G. Takoudis Coord. Chem. Rev. 253 2009 2920
4. J. Chen, X.R. Xing, A. Watson, W. Wang, R.B. Yu, J.X. Deng, L. Yan, C. Sun, and X.B. Chen Chem. Mater. 19 2007 3598
5. M. Valant, A.K. Axelsson, and N. Alford Chem. Mater. 19 2007 5431
6. C. Chen, and J.R. Cheng J. Cryst. Growth 291 2006 135
7. M. Mehring Coord. Chem. Rev. 251 2007 974
8. J.R. Eveland, J.Y. Saillard, and K.H. Whitmire Inorg. Chem. 36 1997 4387
9. M.R. Churchill, J.C. Fettinger, K.H. Whitmire, and C.B. Lagrone J. Organomet. Chem. 303 1986 99
10. K.H. Whitmire, C.B. Lagrone, M.R. Churchill, J.C. Fettinger, and L.V. Biondi Inorg. Chem. 23 1984 4227
11. K.H. Whitmire, C.B. Lagrone, and A.L. Rheingold Inorg. Chem. 25 1986 2472
12. M.R. Churchill, J.C. Fettinger, and K.H. Whitmire J. Organomet. Chem. 284 1985 13
13. K.H. Whitmire, K.S. Raghuveer, M.R. Churchill, J.C. Fettinger, and R.F. See J. Am. Chem. Soc. 108 1986 2778
14. K.H. Whitmire, M.R. Churchill, and J.C. Fettinger J. Am. Chem. Soc. 107 1985 1056
15. K.Y. Monakhov, T. Zessin, and G. Linti Eur. J. Inorg. Chem. 2010 3212
16. T. Gröer, and M. Scheer Organometallics 19 2000 3683
17. H. Braunschweig, P. Cogswell, and K. Schwab Coord. Chem. Rev. 255 2011 101
18. F. Hein, and H. Pobloth Z. Anorg. Allg. Chem. 248 1941 84
19. H.J. Breunig, and U. Gräfe Z. Anorg. Allg. Chem. 510 1984 104
20. H.J. Breunig, T. Borrmann, E. Lork, O. Moldovan, C.I. Rat, and R.P. Wagner J. Organomet. Chem. 694 2009 427
21. L. Balazs, H.J. Breunig, and E. Lork Z. Anorg. Allg. Chem. 630 2004 1937
22. M. Shieh, Y. Liou, M.H. Hsu, R.T. Chen, S.J. Yeh, S.M. Peng, and G.H. Lee Angew. Chem. Int. Ed. Engl. 41 2002 2384
23. C.H. Wei, and L.F. Dahl J. Am. Chem. Soc. 91 1969 1351
24. K.H. Whitmire, M. Shieh, and J. Cassidy Inorg. Chem. 28 1989 3164
25. M.H. Shieh, Y.T. Liou, and B.W. Jeng Organometallics 12 1993 4926
26. J.M. Cassidy, and K.H. Whitmire Inorg. Chem. 30 1991 2788
27. H. Alper, and M. Salisova Tetrahedron Lett. 21 1980 801
28. H.J. Breunig, L. Koenigsmann, E. Lork, M. Nema, N. Philipp, C. Silvestru, A. Soran, R.A. Varga, and R. Wagner J. Chem. Soc. Dalton Trans. 2008 1831
29. S.F. Yin, J. Maruyama, T. Yamashita, and S. Shimada Angew. Chem. Int. Ed. Engl. 47 2008 6590
30. W. Dai, S. Luo, S.F. Yin, and C. Au Front. Chem. Eng. China 4 2010 163
31. J.H. Thurston, D.C. Swenson, and L. Messerle Chem. Commun. 2005 4228
32. R.B. King Inorg. Chem. 42 2003 8755
33. M. Lindsjo, A. Fischer, and L. Kloo Eur. J. Inorg. Chem. 2005 670
34. L. Xu, and S.C. Sevov Inorg. Chem. 39 2000 5383
35. A.D. Becke J. Chem. Phys. 98 1993 5648
36. C. Lee, W. Yang, and R.G. Parr Phys. Rev. B. 37 1988 785
37. F. Weigend, and R. Ahlrichs Phys. Chem. Chem. Phys. 7 2005 3297
38. A. Schäfer, H. Horn, and R. Ahlrichs J. Chem. Phys. 97 1992 2571
39. The geometry optimization has been carried out using the Turbomole program package:
40. R. Ahlrichs, M. Bär, M. Häser, H. Horn, and C. Kölmel Chem. Phys. Lett. 162 1989 165
41. O. Treutler, and R. Ahlrichs J. Chem. Phys. 102 1995 346
42. For the NBO Analysis the B3-LYP functional and the Ahlrichs VTZ basis (using the Stuttgard RLC ECP (W. Kühle, M. Dolg, H. Stoll, and H. Preuss J. Chem. Phys. 100 1994 7535 ) for Bi) have been used as supplied in the NWChem package
43. The NBO analysis has been carried out using the NBO package (A.E. Reed, L.A. Curtiss, and F. Weinhold Chem. Rev. 88 1988 899 ) as interfaced to NWChem (NWChem, A Computational Chemistry Package for Parallel Computers, Version 5.1; Pacific Northwest National Laboratory: Richland, WA, 2007)
44. D.F. Shriver, and M.A. Drezdon The Manipulation of Air-Sensitive Compounds second ed. 1969 McGraw-Hill New York, USA
45. S. Paalasmaa, D. Mansfeld, M. Schürmann, and M. Mehring Z. Anorg. Allg. Chem. 631 2005 2433
46. W.J. Evans, J.H. Hain Jr., and J. Ziller J. Chem. Soc. Chem. Commun. 1989 1628
47. T. Hatanpäaa, M. Vehkamäki, M. Ritala, and M. Leskelä J. Chem. Soc. Dalton Trans. 39 2010 3219
48. G.M. Sheldrick Acta Crystallogr., A 46 1990 467
49. G.M. Sheldrick SHELXL-97, Program for Crystal Structure Refinement 1997 Universität Göttingen Göttingen, Germany
50. -3). Acoording to W. Massa (Kristallstrukturbestimmung, Teubner Studienbücher, Stuttgart, 1996) and W. Clegg (Crystal Structure Determination, Oxford University Press, 1998) this might be observed for heavy atoms for which remaining density peaks with ca. 10% of the electron density of the heavy atom are expected at distances between 0.6 and 1.2. In addition, these unrefined electron density peaks might be attributed to large absorption effects. Repeated measurements of 1 with Mo-Kα radiation, however, did not give satisfying results as the number of observed reflections was always ca. 30% only.