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Information card for entry 4079394
Preview
Coordinates | 4079394.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C40 H30 Co F6 P |
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Calculated formula | C40 H30 Co F6 P |
SMILES | [Co]1234567([c]8([cH]1[cH]2[cH]3[cH]48)[c+]1cccccc1)[C]1(=[C]5([C]6(=[C]71c1ccccc1)c1ccccc1)c1ccccc1)c1ccccc1.[P](F)(F)(F)(F)(F)[F-] |
Title of publication | Dipolar Sesquifulvalene Compounds with (Tetraaryl-η4-cyclobutadiene)(η5- cyclopentadienediyl)cobalt(I) Complex Units as Electron Donors |
Authors of publication | Dabek, Sven; Prosenc, Marc Heinrich; Heck, Jürgen |
Journal of publication | Organometallics |
Year of publication | 2012 |
Journal volume | 31 |
Journal issue | 19 |
Pages of publication | 6911 |
a | 15.79 ± 0.003 Å |
b | 10.083 ± 0.002 Å |
c | 21.042 ± 0.004 Å |
α | 90° |
β | 106.49 ± 0.03° |
γ | 90° |
Cell volume | 3212.3 ± 1.2 Å3 |
Cell temperature | 293 ± 2 K |
Ambient diffraction temperature | 293 ± 2 K |
Number of distinct elements | 5 |
Space group number | 14 |
Hermann-Mauguin space group symbol | P 1 21/c 1 |
Hall space group symbol | -P 2ybc |
Residual factor for all reflections | 0.0724 |
Residual factor for significantly intense reflections | 0.0446 |
Weighted residual factors for significantly intense reflections | 0.0964 |
Weighted residual factors for all reflections included in the refinement | 0.1075 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.013 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
For the version history of this entry, please navigate to main COD server.
The link is: https://www.crystallography.net/4079394.html
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