Bonding characteristics mediated by saddle-shaped porphyrin deformation: A theoretical approach to the control of spin state of iron(III) porphyrins

Chemistry - A European Journal

Volumn 5, Issue 6, 1999, Pages 1708-1715

  Cheng, Ru Jen ^a   Chen, Ping Yu ^a  

^a NATIONAL CHUNG HSING UNIVERSITY   (Taiwan)

Author keywords

Iron; Porphyrinoids; Semiempirical calculations; Spin states; Symmetry switch

Indexed keywords

FERRIC ION; PORPHYRIN DERIVATIVE;

ARTICLE; CALCULATION; COMPLEX FORMATION; CONFORMATIONAL TRANSITION; MOLECULAR INTERACTION; MOLECULAR STABILITY;

EID: 0033016924     PISSN: 09476539     EISSN: None     Source Type: Journal    
DOI: 10.1002/(SICI)1521-3765(19990604)5:6<1708::AID-CHEM1708>3.0.CO;2-Z     Document Type: Article

References (28)

1. W. R. Scheidt, C. A. Reed, Chem. Rev. 1981, 81, 543-555.
2. C. A. Reed, T. Mashiko, S. P. Bentley, M. E. Kastner, W. R. Scheidt, K. Spartalian, G. Lang, J. Am. Chem. Soc. 1979, 101, 2948-2958.
3. A. D. Boersma, H. M. Goff, Inorg. Chem. 1982, 21, 581-586.
4. H. Goff, E. Shimomura, J. Am. Chem. Soc. 1980, 102, 31-37.
5. H. Masuda, T. Taga, K. Osaki, H. Sugimoto, Z.-I. Yoshida, H. Ogoshi, Inorg. Chem. 1980, 19, 950-955.
6. D. H. Dolphin, J. R. Sams, T. B. Tsin, Inorg. Chem. 1977, 16, 711-713.
7. A. Gismelseed, E. L. Bominaar, E. Bill, A. X. Trautwein, H. Winkler, H. Nasri, P. Doppelt, D. Mandon, J. Fischer, R. Weiss, Inorg. Chem. 1990, 29, 2741-2749.
8. C. A. Reed, F. Guiset, J. Am. Chem. Soc. 1996, 118, 3281-3282.
9. R.-J. Cheng, P.-Y. Chen, P.-R. Gau, C-C. Chen, S.-M. Peng, J. Am. Chem. Soc. 1997, 119, 2563-2569.
10. Abbreviations used in this paper: OEP = dianion of octaethylporphyrin; TPP = dianion of meso-tetraphenylporphyrin; OETPP = dianion of octaethyltetraphenylporphyrin; OMTPP = dianion of octamethyltetraphenylporphyrin; OETAP = dianion of octaethyltetraazaporphyrin.
11. B. Kennedy, G. Brain, K. Murray, Inorg. Chim. Acta. 1984, 81, L29-L31.
12. B. Kennedy, K. Murray, P. Zwack, H. Homborg, W. Kalz, Inorg. Chem. 1986, 25, 2539-2545.
13. J. P. Fitzgerald, B. S. Haggerty, A. L. Rheingold, L. May, Inorg. Chem. 1992, 37, 2006-2013.
14. M. M. Maltempo, J. Chem. Phys. 1974, 61, 2540-2547.
15. F. U. Axe, C. Flowers, G. H. Loew, A. Waleh, J. Am. Chem. Soc. 1989, 111, 7333-7339.
16. M. C. Zerner, in Reviews in Computational Chemistry, Vol.2 (Eds.: K. B. Lipkowitz, D. B. Boyd), VCH, New York, 1991, pp. 313-365.
17. M. C. Zerner, in Metal - Ligand Interactions (Eds.: N. Russo, D. R. Salahub), Kluwer Academic, Netherlands, 1996, pp. 493-531.
18. C. Mealli, D. M. Proserpio, J. Chem. Edu. 1990, 67, 399-402.
19. J. H. Ammeter, H.-B. Burgi, J. C. Thibeault, R. Hoffmann, J. Am. Chem. Soc. 1978, 100, 3686-3692.
20. R. H. Summerville, R. Hoffmann, J. Am. Chem. Soc. 1976, 98, 7240-7253.
21. W. R. Scheidt, M. G. Finnegan, Acta Crystallogr. 1989, C45, 1214-1216.
22. S. Mitra, in Iron Porphyrins, Vol. 2 (Eds.: A. B. P. Lever, H. B. Gray), Addison-Wesley, Reading, Massachusetts, 1983, pp. 1-42.
23. V. R. Marathe, S. Mitra, J. Chem. Phys. 1983, 78, 915-920.
24. D. K. Geiger, W. R. Scheidt, Inorg. Chem. 1984, 23, 1970-1972.
25. K. M. Barkigia, M. Dolores Berber, J. Fajer, C. J. Medforth, M. W. Renner, K. M. Smith, J. Am. Chem. Soc. 1990, 112, 8851-8857.
26. R.-J. Cheng, Y.-R. Chen, C.-E. Chuang, Heterocycles 1992, 34, 1-4.
27. a) C.-Y. Lin, S. Hu, T. Rush III, T. G. Spiro, J. Am. Chem. Soc. 1996, 118, 9452-9453;
28. b) S. A. Sibilia, S. Hu, C. Piffat, D. Melamed, T. G. Spiro, Inorg. Chem. 1997, 36, 1013-1019.