Hydrogen bonding in organometallic crystals. 3.1 Transition-metal complexes containing amido groups

Organometallics

Volumn 15, Issue 4, 1996, Pages 1284-1295

  Biradha, Kumar ^a   Desiraju, Gautam R ^a   Braga, Dario ^b   Grepioni, Fabrizia ^b  

^a UNIVERSITY OF HYDERABAD   (India)

^b UNIVERSITY OF BOLOGNA   (Italy)

Author keywords

[No Author keywords available]

Indexed keywords

EID: 0000635386     PISSN: 02767333     EISSN: None     Source Type: Journal    
DOI: 10.1021/om950530h     Document Type: Article

References (36)

1. Part 2: Braga, D.; Biradha, K.; Grepioni, F.; Pedireddi, V. R.; Desiraju, G. R. J. Am. Chem. Soc. 1995, 117, 3156.
2. (a) Jeffrey, G. A.; Saenger, W. Hydrogen Bonding in Biological Structures; Springer-Verlag: Berlin, 1991.
3. (b) Murray-Rust, P.; Glusker, J. P. J. Am. Chem. Soc. 1984, 106, 1018.
4. (c) Jeffrey, G. A.; Maluszynska, H.; Mitra, J. Int. J. Biol. Macromol. 1985, 7, 336.
5. (d) Steiner, T.; Saenger, W. Acta Crystallogr., Sect. B 1992, B48, 819.
6. (e) Taylor, R.; Kennard, O. Acc. Chem. Res. 1984, 17, 320.
7. (a) Lehn, J. M. Angew. Chem., Int. Ed. Engl. 1990,29, 1304.
8. (b) Whitesides, G. M.; Simanek, E. E.; Mathias, J. P.; Seto, C. T.; Chin, D. N.; Mammen, M.; Gordon, D. M. Acc. Chem. Res. 1995, 28, 37.
9. (a) Desiraju, G. R. Crystal Engineering: The Design of Organic Solids; Elsevier: Amsterdam, 1989.
10. (b) Desiraju, G. R. Angew. Chem., in press.
11. (c) Sharma, C. V. K.; Desiraju, G. R. In Perspective in Supramulecular Chemistry. The Crystal as a Supramolecular Entity; Desiraju, G. D., Ed.; Wiley: New York, in press.
12. Braga, D.; Grepioni, F.; Sabatino, P.; Desiraju, G. R. Organometallics 1994, 13, 3532.
13. (a) Braga, D.; Grepioni, F. Acc. Chem. Res. 1994, 27, 51.
14. (b) Braga, D.; Dyson, P. J.; Grepioni, F.; Johnson, B. F. G.; Calhorda, M. J. Inorg. Chem. 1994, 33, 3218.
15. (c) Braga, D.; Grepioni, F.; Calhorda, M. J.; Veiros, L. Organometallics 1995, 14, 1992.
16. The term "organometallic" will be used throughout this paper to refer to compounds containing at least one transition-metal atom and an organic residue.
17. (a) Leiserowitz, L.; Schmidt, G. M. J. Chem. Soc. A 1969, 2372.
18. (b) Leiserowitz, L.; Hagler, A. T. Proc. R. Soc. London 1983, 388, 133.
19. (c) Hagler, A. T.; Huler, E.; Lifson, S. J. Am. Chem. Soc. 1974, 96, 5319.
20. Dauber, P.; Hagler, A. T. Acc. Chem. Res. 1980, 13, 105.
21. Gavezzotti, A.; Fillippini, G. J. Phys. Chem. 1994, 98, 4831.
22. Berkovitch-Yellin, Z.; Leiserowitz, L. J. Am. Chem. Soc. 1980, 102, 7677.
23. Hagler, A. T.; Leiserowitz, L. J. Am. Chem. Soc. 1978, 100, 5879.
24. Allen, F. H.; Davies, J. E.; Galloy, J. J.; Johnson, O.; Kennard, O.; Macrae, C. F.; Watson, D. G. J. Chem. Inf. Comput. Sci. 1991, 31, 204.
25. (a) Keller, E. SCHAKAL93, Graphical Representation of Molecular Models; University of Freiburg, Freiburg, Germany,
26. (b) Spek, A. L. Acta Crystallogr. 1990, A46, C31.
27. 2 analysis for the H⋯O distributions showed that they are deviating from normal distribution and that these deviations are larger in the long H⋯O domain (>2.5 Å). Percentage-wise this effect is more evident for OM than for organics.
28. An interaction is accepted as bifurcated if there are at least two O-atoms within 2.80 Å of an amido H-atom such that both N-H-O angles lie in the range 110-180°. For a more detailed account of the criteria governing bifurcation, see: Parthasarthy, R. Acta Crystallogr., Sect. B 1969, B25, 509.
29. Kroon, J.; Kanters, A. J. Mol. Struct. 1975, 24, 109.
30. The solid angle correction takes into account the different probability of an angular distribution in order to upweigh the more linear contacts, which sweep a smaller solid angle. Obviously, this procedure is more important when a comparison between calculated and observed angular distributions is required.
31. 1
32. Ladell, J.; Post, B. Acta Crystallogr. 1954, 7, 559.
33. (a) Braga, D.; Grepioni, F.; Byrne, J. J.; Wolf, A. J. Chem. Soc., Chem. Commun. 1995, 1023.
34. (b) Braga, D.; Costa, A. L.; Grepioni, F.; Scaccianoce, L.; Tagliavini, E. Organometallics, in press.
35. (a) Braga, D.; Calhorda, M. J.; Dyson, P.; Grepioni, F.; Johnson, B. F. G.; Sanderson, F. M.; Veiros, L. Organometallics 1995, 14, 121.
36. (b) Braga, D.; Grepioni, F.; Byrne, J. J.; Calhorda, M. J. J. Chem. Soc., Dalton Trans. 1995, 3287.