Intramolecular carbonyl⋯carbonyl interactions in W, Mo and Fe complexes containing the η1-N-maleimidato ligand: X-ray, DFT and AIM studies

Journal of Organometallic Chemistry

Volumn 691, Issue 15, 2006, Pages 3232-3238

  Palusiak, Marcin ^a   Rudolf, Bogna ^a   Zakrzewski, Janusz ^a   Pfitzner, Arno ^b   Zabel, Manfred ^b   Grabowski, Sławomir J ^a  

^a UNIVERSITY OF LODZ   (Poland)

^b UNIVERSITY OF REGENSBURG   (Germany)

Author keywords

AIM; Carbonyl carbonyl interactions; DFT; Maleimidato ligand; X ray structures

Indexed keywords

CRYSTAL STRUCTURE; IRON; MOLYBDENUM; NITROGEN; RATE CONSTANTS; SINGLE CRYSTALS; TUNGSTEN; X RAY DIFFRACTION ANALYSIS;

AIM; CARBONYL⋯CARBONYL INTERACTIONS; DFT; LIGANDS; MALEIMIDATO LIGAND; MALEIMIDATO MOIETY; X-RAY STRUCTURES;

COMPLEXATION;

EID: 33745214673     PISSN: 0022328X     EISSN: None     Source Type: Journal    
DOI: 10.1016/j.jorganchem.2006.03.035     Document Type: Article

References (38)

1. Allen F.H., Baalham C.A., Lommerse J.P.M., and Raithby P.R. Acta Crystallogr., Sect. B 54 (1998) 320
2. Dietrich H., Scheringer C., Meyer H., Schulte K.-W., and Schweig A. Acta Crystallogr., Sect. B 35 (1979) 1191
3. Kutoglu A., and Hellner E. Acta Crystallogr., Sect. B 34 (1978) 1617
4. Verschoor G.C., and Keulen E. Acta Crystallogr., Sect. B 27 (1971) 134
5. Lario P.I., and Vrielink A. J. Am. Chem. Soc. 125 (2003) 12787
6. Maccallum P.H., Poet R., and Milner-White J. J. Mol. Biol. 248 (1995) 361
7. Maccallum P.H., Poet R., and Milner-White J. J. Mol. Biol. 248 (1995) 374
8. Roy J., Bhattacharya S., Ghosh S., Majumder D., and Bhattacharyya S.P. Chem. Phis. 222 (1997) 161
9. Hermanson G.T. Bioconjugate Techniques (1996), Academic Press, San Diego, CA
10. Van Staveren D.R., and Metzler-Nolte N. Chem. Rev. 104 (2004) 5931
11. Salmain M., and Jaouen G. C.R. Chimie 6 (2003) 249
12. Guo X.Q., Castellano F.N., Li L., and Lakowicz J.R. Anal. Chem. 70 (1998) 632
13. Dattelbaum J.D., Abugo O.O., and Lakowicz J.R. Bioconjug. Chem. 11 (2000) 533
14. Lo K.K., Hui W.K., Ng D.C., and Cheung K.K. Inorg. Chem. 41 (2002) 40
15. Rudolf B., Palusiak M., Zakrzewski J., Salmain M., and Jaouen G. Bioconjug. Chem. 16 (2005) 1218 and references therein
16. McPhalen C.A., and James M.N.G. Acta Crystallogr., Sect. C 39 (1983) 1439
17. Hohenberg P., and Kohn W. Phys. Rev. B 136 (1964) 864
18. Kohn W., and Sham L.J. Phys. Rev. A 140 (1965) 1133
19. Bader R.F.W. Atoms in Molecules. A Quantum Theory (1994), Clarendon Press, Oxford
20. Popelier P. Atoms in Molecules. An Introduction (2000), Prentice-Hall, Englewood Cliffs, NJ
21. Frisch M.J., Trucks G.W., Schlegel H.B., Scuseria G.E., Robb M.A., Cheeseman J.R., Zakrzewski V.G., Montgomery J.A., Stratmann R.E., Burant J.C., Dapprich S., Millam J.M., Daniels A.D., Kudin K.N., Strain M.C., Farkas O., Tomasi J., Barone V., Cossi M., Cammi R., Mennucci B., Pomelli C., Adamo C., Clifford S., Ochterski J., Petersson G.A., Ayala P.Y., Cui Q., Morokuma K., Malick D.K., Rabuck A.D., Raghavachari K., Foresman J.B., Cioslowski J., Ortiz J.V., Stefanov B.B., Liu G., Liashenko A., Piskorz P., Komaromi I., Gomperts R., Martin L.R., Fox D.J., Keith T., Al-Laham M.A., Peng C.Y., Nanayakkara A., Gonzalez G., Challacombe M., Gill P.M.W., Johnson B., Chen W., Wong M.W., Andres J.L., Gonzalez C., Head-Gordon M., Replogle E.S., and Pople J.A. gaussian-98, Revision A.6 (1998), Gaussian, Inc., Pittsburgh, PA
22. Becke A.D. J. Chem. Phys. 98 (1993) 5648
23. Lee C., Yang W., and Parr R.G. Phys. Rev. B 37 (1988) 785
24. Miehlich B., Savin A., Stoll H., and Preuss H. Chem. Phys. Lett. 157 (1989) 200
25. Krishnan R., Binkley J.S., Seeger R., and Pople J.A. J. Chem. Phys. 72 (1980) 650
26. McLean A.D., and Chandler G.S. J. Chem. Phys. 72 (1980) 5639
27. Hay P.J., and Wadt W.R. J. Chem. Phys. 82 (1985) 270
28. Wadt W.R., and Hay P.J. J. Chem. Phys. 82 (1985) 284
29. Hay P.J., and Wadt W.R. J. Chem. Phys. 82 (1985) 299
30. Breneman C.M., and Wiberg K.B. J. Comput. Chem. 11 (1990) 361
31. F. Biegler-König, aim2000, University of Applied Sciences, Bielefeld, Germany.
32. Allen F.H. Acta Crystallogr., Sect. B 58 (2002) 380
33. Szewczyk B., and Sokalski W.A. J. Chem. Phys. 117 (2002) 6952
34. Martin F., and Zipse H. J. Comput. Chem. 26 (2005) 97
35. In: Sutton L.E. (Ed). Table of Interatomic Distances and Configuration in Molecules and Ions (1965), Chemical Society, London Supplement 1956-1959, Special Publication No. 18
36. Bueno C., and Churchill M.R. Inorg. Chem. 20 (1981) 2197
37. Grabowski S.J. J. Phys. Org. Chem. 17 (2004) 18
38. Grabowski S.J. J. Mol. Struct. 562 (2001) 137