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Crystal and molecular structure of OC(CoC5H5)3(CF3CCCF3)

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Abstract

The structure of the title compound has been confirmed by an X-ray diffraction analysis, and refined by full-matrix least squares. The crystals are mono-clinic:a=9.171(3),b=25.176(15)c=9.192(3) Å,β=117.08(3)°,Z=4,D x =1.976g cm−3,μ=2.66mm¯1, space groupP21/n (No. 14). The finalR value is 5.7%. Interatomic distances and bond angles are compared with those reported in related molecules.

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Authors and Affiliations

  1. Department of Chemistry and Laboratory for Research on the Structure of Matter, University of Pennsylvania, 19104, Philadelphia, Pennsylvania

    Jack M. Gromek & Jerry Donohue

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  1. Jack M. Gromek
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  2. Jerry Donohue
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Additional information

The preferred name of this compound according to the IUPAC rules isμ 3-[1η∶1–2η-bis(trifluoromethyl)vinylene]-μ 3-carbonyl-tris (η-cyclopentadienyl)-triangulo-tricobalt.

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Gromek, J.M., Donohue, J. Crystal and molecular structure of OC(CoC5H5)3(CF3CCCF3). Journal of Crystallographic and Spectroscopic Research 14, 227–237 (1984). https://doi.org/10.1007/BF01161160

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  • DOI: https://doi.org/10.1007/BF01161160

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