메뉴 건너뛰기




Volumn 49, Issue 9, 2010, Pages 4133-4148

Nuclear resonance vibrational spectroscopy applied to [Fe(OEP)(NO)]: The vibrational assignments of five-coordinate ferrous heme-nitrosyls and implications for electronic structure

Author keywords

[No Author keywords available]

Indexed keywords

DINITROSYL IRON COMPLEX; FE(OCTAETHYLPORPHYRINATO)(NO); HEME; IRON; METALLOPORPHYRIN; NITROGEN OXIDE;

EID: 77951533746     PISSN: 00201669     EISSN: None     Source Type: Journal    
DOI: 10.1021/ic902181e     Document Type: Article
Times cited : (42)

References (89)
  • 2
    • 0026669125 scopus 로고
    • Snyder, S. H. Science 1992, 257, 494-496
    • (1992) Science , vol.257 , pp. 494-496
    • Snyder, S.H.1
  • 6
    • 0003600081 scopus 로고    scopus 로고
    • Feelisch, M. and Stamler, J. S., Eds.; Wiley: Chichester.
    • Methods in Nitric Oxide Research; Feelisch, M. and Stamler, J. S., Eds.; Wiley: Chichester, 1996.
    • (1996) Methods in Nitric Oxide Research
  • 30
    • 77949811523 scopus 로고    scopus 로고
    • Electron paramagnetic resonance and low-temperature magnetic circular dichroism spectroscopy of ferrous heme nitrosyls
    • Ghosh, A., Ed.; Elsevier: Amsterdam,; Chapter 6.
    • Lehnert, N. Electron Paramagnetic Resonance and Low-Temperature Magnetic Circular Dichroism Spectroscopy of Ferrous Heme Nitrosyls.; In The Smallest Biomolecules: Perspectives on Heme-Diatomic Interactions; Ghosh, A., Ed.; Elsevier: Amsterdam, 2008; Chapter 6, pp 147-171.
    • (2008) The Smallest Biomolecules: Perspectives on Heme-Diatomic Interactions , pp. 147-171
    • Lehnert, N.1
  • 31
    • 0000122597 scopus 로고    scopus 로고
    • Binding and activation of nitric oxide by metalloporphyrins and heme
    • Kadish, K. M., Smith, K. M., and Guilard, R., Eds.; Academic Press: New York,; Vol., Chapter 33.
    • Cheng, L. and Richter-Addo, G. B. Binding and Activation of Nitric Oxide by Metalloporphyrins and Heme. In The Porphyrin Handbook; Kadish, K. M., Smith, K. M., and Guilard, R., Eds.; Academic Press: New York, 2000; Vol. 4, Chapter 33, pp 219-291.
    • (2000) The Porphyrin Handbook , vol.4 , pp. 219-291
    • Cheng, L.1    Richter-Addo, G.B.2
  • 34
    • 33645866880 scopus 로고    scopus 로고
    • Iron porphyrin chemistry
    • 2 nd ed., King, R. B., Ed.; John Wiley & Sons, Ltd.: Chichester.
    • Walker, F. A. and Simonis, U. Iron Porphyrin Chemistry. In Encyclopedia of Inorganic Chemistry, 2 nd ed.; King, R. B., Ed.; John Wiley & Sons, Ltd.: Chichester, 2005; Vol. IV, pp 2390-2521.
    • (2005) Encyclopedia of Inorganic Chemistry , vol.4 , pp. 2390-2521
    • Walker, F.A.1    Simonis, U.2
  • 35
  • 55
    • 33745770836 scopus 로고
    • 1985, 82, 299-310
    • Hay, P. J. and Wadt, W. R. J. Chem. Phys. 1985, 82, 270-283; 1985, 82, 299-310
    • (1985) J. Chem. Phys. , vol.82 , pp. 270-283
    • Hay, P.J.1    Wadt, W.R.2
  • 58
    • 0038626673 scopus 로고    scopus 로고
    • Gaussian, Inc.: Pittsburgh, PA.
    • Frisch, M. J., et al. Gaussian 03; Gaussian, Inc.: Pittsburgh, PA, 2003.
    • (2003) Gaussian 03
    • Frisch, M.J.1
  • 60
    • 65249177378 scopus 로고    scopus 로고
    • Quantum Chemistry Centered Normal Coordinate Analysis (QCC-NCA): Routine Application of Normal Coordinate Analysis for the Simulation of the Vibrational Spectra of large Molecules
    • Encyclopedia of Inorganic Chemistry;, Eds.; John Wiley & Sons, Ltd.: Chichester, U.K..
    • Lehnert, N. Quantum Chemistry Centered Normal Coordinate Analysis (QCC-NCA): Routine Application of Normal Coordinate Analysis for the Simulation of the Vibrational Spectra of large Molecules. In Computational Inorganic and Bioinorganic Chemistry; Encyclopedia of Inorganic Chemistry; Solomon, E. I., King, R. B., and Scott, R. A., Eds.; John Wiley & Sons, Ltd.: Chichester, U.K., 2009; pp 123-140.
    • (2009) Computational Inorganic and Bioinorganic Chemistry , pp. 123-140
    • Lehnert, N.1    Solomon, E.I.2    King, R.B.3    Scott, R.A.4
  • 73
    • 77951569037 scopus 로고    scopus 로고
    • Differences in diagonal force constants are negligible. In the case of non-diagonal elements, differences are in general below 5%.
    • Differences in diagonal force constants are negligible. In the case of non-diagonal elements, differences are in general below 5%.
  • 79
    • 77951524317 scopus 로고    scopus 로고
    • Note
    • u-components changes correspondingly in the porphyrin plane. This change in direction affects their coupling with motions of the ethyl substituents, leading to the observed NRVS differences of porphyrin core modes in different conformers. See: Lehnert, N., Sage, J. T., Scheidt, W. R., Sturhahn, W., and Zhao, J., manuscript in preparation.
    • Lehnert, N.1    Sage, J.T.2    Scheidt, W.R.3    Sturhahn, W.4    Zhao, J.5
  • 82
    • 77951611705 scopus 로고    scopus 로고
    • Note
    • 2- complexes for the purpose of detailed vibrational analyses.
  • 84
    • 77951545581 scopus 로고    scopus 로고
    • Note
    • h. In the case of S = 1/2 systems as considered here, spin polarization effects are usually small.


* 이 정보는 Elsevier사의 SCOPUS DB에서 KISTI가 분석하여 추출한 것입니다.