Transition metal silyl complexes LVI [1]. (CO)4Fe(H)SiR3 and [(CO)4FeSiR3]- - A density functional study on the influence of the substituents at silicon on the electronic properties of the metal center

Monatshefte fur Chemie

Volumn 129, Issue 4, 1998, Pages 329-338

  Kickelbick, Guido ^a   Schubert, Ulrich ^a  

^a VIENNA UNIVERSITY OF TECHNOLOGY   (Austria)

Author keywords

Anionic metal complexes; Density functional study; Metal silyl complexes; Silicon compounds

Indexed keywords

EID: 0032379988     PISSN: 00269247     EISSN: None     Source Type: Journal    
DOI: 10.1007/PL00000091     Document Type: Article

References (32)

1. Part 55: Gilges H, Kickelbick G, Schubert U (1997) J Organomet Chem 548: 57
2. Schubert U, Kirchgäßner U, Grönen J, Piana H (1989) Polyhedron 8: 1589; Kirchgäßner U, Piana H, Schubert U (1991) J Am Chem Soc 113: 2228
3. Schubert U, Kirchgäßner U, Grönen J, Piana H (1989) Polyhedron 8: 1589; Kirchgäßner U, Piana H, Schubert U (1991) J Am Chem Soc 113: 2228
4. Hieber W, Lindner E (1961) Chem Ber 94: 1417
5. Bursten BE, Gatter MG (1984) J Am Chem Soc 106: 2554; Bursten BE, Gatter MG (1984) Organometallics 3: 895
6. Bursten BE, Gatter MG (1984) J Am Chem Soc 106: 2554; Bursten BE, Gatter MG (1984) Organometallics 3: 895
7. Simpson KA (1973) Thesis, Univ. of Alberta, Edmonton
8. Folga E, Ziegler T (1993) J Am Chem Soc 115: 5169
9. McNeill EA, Scholer FR (1977) J Am Chem Soc 99: 6243
10. Kukolich SG, Sickafoose SM, Breckenridge SM (1996) J Am Chem Soc 118: 205
11. Jonas V, Thiel W (1996) J Chem Phys 105: 3636
12. Jansen PR, Oskam A, Olie K (1975) Cryst Struct Commun 4: 667
13. Novak I, Huang W, Luo L, Hua H, Ang HG, Zybill CE (1997) Organometallics 16: 1567
14. Ahlrichs R, Ehrhardt C (1985) Chemie i u Zeit 19: 120
15. Fan L, Ziegler T (1991) J Chem Phys 95: 7401; Ziegler T, Versluis L, Tschinke V (1986) J Am Chem Soc 108: 612; Ziegler T, Tschinke V, Becke A (1987) J Am Chem Soc 109: 1351
16. Fan L, Ziegler T (1991) J Chem Phys 95: 7401; Ziegler T, Versluis L, Tschinke V (1986) J Am Chem Soc 108: 612; Ziegler T, Tschinke V, Becke A (1987) J Am Chem Soc 109: 1351
17. Fan L, Ziegler T (1991) J Chem Phys 95: 7401; Ziegler T, Versluis L, Tschinke V (1986) J Am Chem Soc 108: 612; Ziegler T, Tschinke V, Becke A (1987) J Am Chem Soc 109: 1351
18. Wong MW (1996) Chem Phys Lett 256: 391
19. Jetz W, Graham WAG (1971) Inorg Chem 10: 1647
20. Dixon DA, Gole JL, Komornicki A (1988) J Phys Chem 92: 2134; von Nagy-Felsobuki EI, Kimura K (1990) J Phys Chem 94: 8041; Chandra AK, Goursot A (1996) J Phys Chem 100: 11596
21. Dixon DA, Gole JL, Komornicki A (1988) J Phys Chem 92: 2134; von Nagy-Felsobuki EI, Kimura K (1990) J Phys Chem 94: 8041; Chandra AK, Goursot A (1996) J Phys Chem 100: 11596
22. Dixon DA, Gole JL, Komornicki A (1988) J Phys Chem 92: 2134; von Nagy-Felsobuki EI, Kimura K (1990) J Phys Chem 94: 8041; Chandra AK, Goursot A (1996) J Phys Chem 100: 11596
23. Moore EJ, Sullivan JM, Norton JR (1986) J Am Chem Soc 108: 2257; Eidin RT, Sullivan JM, Norton JR (1987) J Am Chem Soc 109: 3945
24. Moore EJ, Sullivan JM, Norton JR (1986) J Am Chem Soc 108: 2257; Eidin RT, Sullivan JM, Norton JR (1987) J Am Chem Soc 109: 3945
25. Brauman JI, Blair LK (1970) J Am Chem Soc 92: 5968
26. Vosko SH, Wilk L, Nusair M (1980) Can J Phys 57: 1200
27. Becke AD (1993) J Chem Phys 98: 5648
28. Lee C, Yang W, Parr RG (1988) Phys Rev B 37: 785
29. Frisch MJ, Trucks GW, Schlegel HB, Gill PMW, Johnson BG, Wong MW, Foresman JB, Robb MA, Head-Gordon M, Replogle ES, Gomperts R, Andres JL, Raghavachari K, Binkley JS, Gonzalez C, Martin RL, Fox DJ, Defrees DJ, Baker J, Stewart JJP, Pople JA (1995) Gaussian, Inc., Pittsburgh, PA
30. Hay PJ, Wadt WR (1985) J Chem Phys 82: 270, 299
31. Dunning TH Jr (1989) J Chem Phys 90: 1007
32. NBO Version 3.1, Glendening ED, Reed AE, Carpenter JE, Weinhold F, Reed AE, Curtiss LA, Weinhold F (1988) Chem Rev 88: 899