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Volumn 109, Issue 23, 1987, Pages 7025-7031

Molecular and Electronic Structure of (L-Histidinato)pentammineruthenium(III) Chloride Monohydrate, (NH3)5Rum(his)Cl3*H20: X-ray Structure, Single-Crystal Polarized Charge-Transfer Spectra, and ab Initio and Semiempirical Molecular Orbital Calculations

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EID: 0342928413     PISSN: 00027863     EISSN: 15205126     Source Type: Journal    
DOI: 10.1021/ja00257a020     Document Type: Article
Times cited : (65)

References (41)
  • 3
    • 33845470145 scopus 로고
    • (b) Bechtold, R.; Kuehn, C.; Lepre, C.; Isied, S. S. Nature (London) 1986, 322, 286.
    • Isied, S. S.; Kuehn, C.; Worosila, G. J. J. Am. Chem. Soc. 1984, 106, 1722. (b) Bechtold, R.; Kuehn, C.; Lepre, C.; Isied, S. S. Nature (London) 1986, 322, 286.
    • (1984) J. J. Am. Chem. Soc. , vol.106 , pp. 1722
    • Isied, S.S.1    Kuehn, C.2    Worosila, G.3
  • 6
    • 0001509821 scopus 로고
    • Progress in Inorganic
    • Lippard, S. J., Ed.; John Wiley & Sons, Inc. New York
    • Meyer, T. J. In Progress in Inorganic Chemistry; Lippard, S. J., Ed.; John Wiley & Sons, Inc.: New York, 1983; Vol. 30, p 389.
    • (1983) Chemistry , vol.30 , pp. 389
    • Meyer, T.J.1
  • 17
    • 0003446756 scopus 로고
    • MULTAN 82. A System of Computer Programs for the Automatic Solution of Crystal Structures from X-ray Diffraction Data. University of York, England and Louvain
    • Belgium
    • Main, P.; Fiske, S. J.; Hull, S. E.; Lessinger, L.; Germain, G.; Declercq, J. P.; Woolfson, M. M.; MULTAN 82. A System of Computer Programs for the Automatic Solution of Crystal Structures from X-ray Diffraction Data. University of York, England and Louvain, Belgium, 1982.
    • (1982)
    • Main, P.1    Fiske, S.J.2    Hull, S.E.3    Lessinger, L.4    Germain, G.5    Declercq, J.P.6    Woolfson, M.M.7
  • 20
    • 2342430094 scopus 로고
    • (b) Pople, J. A.; Nesbet, R. K. J. Chem. Phys. 1954, 22, 571. (c) Mulliken, R. S. J. Chem. Phys. 1955, 23, 1833. (d) Roothaan, C. C. J. Rev. Mod. Phys. 1960, 32, 179.
    • Roothaan, C. C. J. Rev. Mod. Phys. 1951, 23, 69. (b) Pople, J. A.; Nesbet, R. K. J. Chem. Phys. 1954, 22, 571. (c) Mulliken, R. S. J. Chem. Phys. 1955, 23, 1833. (d) Roothaan, C. C. J. Rev. Mod. Phys. 1960, 32, 179.
    • (1951) J. Rev. Mod. Phys. , vol.23 , pp. 69
    • Roothaan, C.C.1
  • 21
    • 33745770836 scopus 로고
    • (b) Stevens, W. J.; Basch, H.; Krauss, M. J. Chem. Phys. 1984, 81, 6026. (c) Hehre, W. J.; Stewart, R. F.; Pople, J. A. J. Chem. Phys. 1969, 51, 2657
    • Hay, P. J.; Wadt, W. R. J. Chem. Phys. 1985, 82, 270. (b) Stevens, W. J.; Basch, H.; Krauss, M. J. Chem. Phys. 1984, 81, 6026. (c) Hehre, W. J.; Stewart, R. F.; Pople, J. A. J. Chem. Phys. 1969, 51, 2657.
    • (1985) J. Chem. Phys. , vol.82 , pp. 270
    • Hay, P.J.1    Wadt, W.R.2
  • 22
    • 33847086509 scopus 로고
    • (b) Zerner, M.; Bacon, A. D. Theor. Chim. Acta 1979, 53, 21. (c) Ridley, J.; Zerner, M. Theor. Chim. Acta 1973, 32, 11; 1976, 42, 233; Zerner, M., private communication.
    • Zerner, M. C.; Loew, G. H.; Kirchner, R. F.; Mueller-Westerhoff, U. T. J. Am. Chem. Soc. 1980, 102, 589. (b) Zerner, M.; Bacon, A. D. Theor. Chim. Acta 1979, 53, 21. (c) Ridley, J.; Zerner, M. Theor. Chim. Acta 1973, 32, 11; 1976, 42, 233; Zerner, M., private communication.
    • (1980) J. Am. Chem. Soc. , vol.102 , pp. 589
    • Zerner, M.C.1    Loew, G.H.2    Kirchner, R.F.3    Mueller-Westerhoff, U.T.4
  • 23
    • 0342290612 scopus 로고
    • (U. S.) (b) Anno, T.; Teruya, H. Theor. Chim. Acta 1971, 21, 127; J. Chem. Phys. 1970, 52, 2840. Anno, T.; Sakai, Y. J. Chem. Phys. 1972, 57, 4910. Hinze, J.; Jaffe, H. H. J. Chem. Phys. 1963, 38, 1834.
    • Moore, C. E. Natl. Bur. Std. Circ. (U. S.) 1958, 467, 3. (b) Anno, T.; Teruya, H. Theor. Chim. Acta 1971, 21, 127; J. Chem. Phys. 1970, 52, 2840. Anno, T.; Sakai, Y. J. Chem. Phys. 1972, 57, 4910. Hinze, J.; Jaffe, H. H. J. Chem. Phys. 1963, 38, 1834.
    • (1958) Natl. Bur. Std. Circ. , vol.467 , pp. 3
    • Moore, C.E.1
  • 24
    • 84943032324 scopus 로고
    • Weiss, K., unpublished results.
    • Mataga, M.; Nishimoto, K. Z. Phys. Chem. 1957, 13, 140. Weiss, K., unpublished results.
    • (1957) Z. Phys. Chem. , vol.13 , pp. 140
    • Mataga, M.1    Nishimoto, K.2
  • 27
    • 0001053565 scopus 로고
    • (b) Wishart, J. F.; Bino, A.; Taube, H. Inorg. Chem. 1986, 25, 3318.
    • Gress, M. E.; Creutz, C.; Quicksall, C. O. Inorg. Chem. 1981, 20 1522. (b) Wishart, J. F.; Bino, A.; Taube, H. Inorg. Chem. 1986, 25, 3318.
    • (1981) Inorg. Chem. , vol.20 , pp. 1522
    • Gress, M.E.1    Creutz, C.2    Quicksall, C.O.3
  • 28
    • 0038965374 scopus 로고
    • (b) Keppler, B. K.; Wehe, D.; Endres, H.; Rupp, W. Inorg. Chem. 1987, 26, 844.
    • Richardson, D. E.; Walker, D. D.; Sutton, J. E.; Hodgson, K. O.; Taube, H. Inorg. Chem. 1979, 18, 2216. (b) Keppler, B. K.; Wehe, D.; Endres, H.; Rupp, W. Inorg. Chem. 1987, 26, 844.
    • (1979) Inorg. Chem. , vol.18 , pp. 2216
    • Richardson, D.E.1    Walker, D.D.2    Sutton, J.E.3    Hodgson, K.O.4    Taube, H.5
  • 31
    • 85022541869 scopus 로고
    • (b) Craddock S,; Findlay, R. H.; Palmer, M. H. Tetrahedron 1973, 29, 2173. Ramsey, B. G. J. Org. Chem. 1979, 44, 2093.
    • Koopmans, T. C. Physica (Utrecht) 1934, / 104. (b) Craddock S,; Findlay, R. H.; Palmer, M. H. Tetrahedron 1973, 29, 2173. Ramsey, B. G. J. Org. Chem. 1979, 44, 2093.
    • (1934) Physica (Utrecht) , pp. 104
    • Koopmans, T.C.1
  • 32
    • 85022587113 scopus 로고
    • Melson, G. A., Figgis, B. N., Eds.; Marcel Dekker Inc. New York
    • Bencini, A.; Gatteschi, D. In Transition Metal Chemistry; Melson, G. A., Figgis, B. N., Eds.; Marcel Dekker Inc.: New York, 1982; Vol. 8, p 11.
    • (1982) Transition Metal Chemistry , vol.8 , pp. 11
    • Bencini, A.1    Gatteschi, D.2
  • 34
    • 0000934574 scopus 로고
    • There are two low-lying states calculated near 250 cm-1 above the ground state. These states correspond to alternative occupancies of the five d-electrons within the quasidegenerate t2g set. For other theoretical work on the optical spectra of Ru(NH3)63+ see
    • Ondrechen, M. J.; Ratner, M. A.; Ellis, D. E. J. Am. Chem. Soc. 1981, 103, 1656. Guenzburger, D.; Gamier, A.; Danon, J. Inorg. Chim. Acta 1977, 21, 119.
    • There are two low-lying states calculated near 250 cm-1 above the ground state. These states correspond to alternative occupancies of the five d-electrons within the quasidegenerate t2g set. For other theoretical work on the optical spectra of Ru(NH3)63+ see: Daul, C.; Goursot, A. Inorg. Chem. 1985, 24, 3554. Ondrechen, M. J.; Ratner, M. A.; Ellis, D. E. J. Am. Chem. Soc. 1981, 103, 1656. Guenzburger, D.; Gamier, A.; Danon, J. Inorg. Chim. Acta 1977, 21, 119.
    • (1985) Inorg. Chem. , vol.24 , pp. 3554
    • Daul, C.1    Goursot, A.2


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