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Conformational analysis of mono- and di-C-substituted derivatives ofcloso-3,3-[η2,3-(2-methylenebicyclo[2.2.1]hepta-2,5-dien-2-yl)]-1-R-2-R1-3,1,2-dicarbollylrhodium (R and R1=h, Me, or PhCH2)-(2-methylenebicyclo[2.2.1]hepta-2,5-dien-2-yl)]-1-R-2-R1-3,1,2-dicarbollylrhodium (R and R1=h, Me, or PhCH2)

  • Physical Chemistry
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Abstract

A model has been developed that allows one to carry out molecular mechanics calculations of metallacarborane complexes with various ligands with the use of the MM3 program package. Based on X-ray structural data on a number of rhodium complexes in which the rhodium atom is coordinated by the η2,3-norbornadienyl and η5-dicarbollyl ligands, a parameter set was developed for the compounds of the above-mentioned series. The use of this model made it possible to study the effects of various factors on the structures of the molecules ofcloso-3,3-(η2,3-methylenenorbornadienyl)-1-R-3, 1,2-dicarbollylrhodium (R=Alk or ArAlk).

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References

  1. L. I. Zakharkin, I. T. Chizhevsky, G. G. Zhigareva, P. V. Petrovskii, A. V. Polyakov, A. I. Yanovsky, and Yu. T. Struchkov,J. Organomet. Chem., 1988,358, 449.

    Article  CAS  Google Scholar 

  2. I. T. Chizhevsky, G. G. Zhigareva, P. V. Petrovskii, and L. I. Zakharkin,Metalloorgan. Khim., 1992,5, 625 [Organomet. Chem. USSR, 1992,5 (Engl. Transl.)].

    Google Scholar 

  3. T. V. Zinevich, I. T. Chizhevskii, A. I. Yanovskii, P. V. Petrovskii, and L. I. Zakharkin,Izv. Akad. Nauk, Ser. Khim., 1997, 2069 [Russ. Chem. Bull., 1997,46, 1965 (Engl. Transl.)].

  4. A. Felekidis, M. Goblet-Stachow, J. F. Liegeois, B. Pirotte, J. Delarge, A. Demonceau, M. Fontaine, A. F. Noels, I. T. Chizhevsky, T. V. Zinevich, V. I. Bregadze, F. M. Dolgushin, A. I. Yanovsky, and Yu. T. Struchkov,J. Organomet. Chem., 1997,536–537, 405.

    Article  Google Scholar 

  5. N. L. Allinger, Y. H. Yuh, and J. -H. Lii,J. Am. Chem. Soc., 1989,111, 8551.

    Article  CAS  Google Scholar 

  6. T. V. Timofeeva and Yu. T. Struchkov,Usp. Khim., 1990,59, 551 [Russ. Chem. Rev., 1990,59, 320 (Engl. Transl.)].

    CAS  Google Scholar 

  7. T. V. Timofeeva, J. -H. Lii, and N. L. Allinger,J. Am. Chem. Soc., 1995,117, 7452.

    Article  CAS  Google Scholar 

  8. T. V. Timofeeva, N. L. Allinger, M. Bel', and U. Matsurek,Izv. Akad. Nauk, Ser. Khim., 1994, 1906 [Russ. Chem. Bull., 1994,43, 1795 (Engl. Transl.)].

  9. T. V. Timofeeva, K. Yu. Suponitsky, A. I. Yanovsky, and N. L. Allinger,J. Organomet. Chem., 1997,536–537, 481.

    Article  Google Scholar 

  10. D. M. Specman, C. B. Knobler, and M. F. Hawthorne,Organometallics, 1985,4, 426.

    Article  Google Scholar 

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Authors and Affiliations

  1. D. I. Mendeleev Russian University of Chemical Technology, 9 Miusskaya pl., 125047, Moscow, Russian Federation

    K. Yu. Suponitsky

  2. A. N. Nesmeyanov Institute of Organoelement Compounds, Russian Academy of Sciences, 28 ul. Vavilova, 117813, Moscow, Russian Federation

    T. V. Timofeeva & I. T. Chizhevsky

  3. Department of Chemistry, The University of Georgia, 30602-2556, Athens, Georgia, USA

    N. L. Allinger

Authors
  1. K. Yu. Suponitsky
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  2. T. V. Timofeeva
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  3. I. T. Chizhevsky
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  4. N. L. Allinger
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Translated fromIzvestiya Akademii Nauk. Seriya Khimicheskaya, No. 4, pp. 617–622, April, 1998.

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Suponitsky, K.Y., Timofeeva, T.V., Chizhevsky, I.T. et al. Conformational analysis of mono- and di-C-substituted derivatives ofcloso-3,3-[η2,3-(2-methylenebicyclo[2.2.1]hepta-2,5-dien-2-yl)]-1-R-2-R1-3,1,2-dicarbollylrhodium (R and R1=h, Me, or PhCH2)-(2-methylenebicyclo[2.2.1]hepta-2,5-dien-2-yl)]-1-R-2-R1-3,1,2-dicarbollylrhodium (R and R1=h, Me, or PhCH2). Russ Chem Bull 47, 596–601 (1998). https://doi.org/10.1007/BF02495960

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  • DOI: https://doi.org/10.1007/BF02495960

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