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Information card for entry 4065333
Preview
Coordinates | 4065333.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C36 H20 Ir5 O12 P |
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Calculated formula | C36 H20 Ir5 O12 P |
SMILES | [Ir]1234([Ir]56([Ir]781([Ir]25([Ir]67(C8=O)(c1ccccc1)(C#[O])C#[O])(C4=O)(C#[O])C#[O])(C#[O])C#[O])(C3=O)(C#[O])C#[O])([P](c1ccccc1)(c1ccccc1)c1ccccc1)C#[O] |
Title of publication | Transmetalation Reactions Yield New Tetra- and Pentairidium Carbonyl Complexes Containing σ-Bonded Phenyl Rings |
Authors of publication | Adams, Richard D.; Chen, Mingwei |
Journal of publication | Organometallics |
Year of publication | 2011 |
Journal volume | 30 |
Journal issue | 21 |
Pages of publication | 5867 |
a | 18.5348 ± 0.0004 Å |
b | 13.0734 ± 0.0003 Å |
c | 15.9317 ± 0.0004 Å |
α | 90° |
β | 103.922 ± 0.001° |
γ | 90° |
Cell volume | 3747.05 ± 0.15 Å3 |
Cell temperature | 294 ± 2 K |
Ambient diffraction temperature | 294 ± 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 | 0.0541 |
Residual factor for significantly intense reflections | 0.0453 |
Weighted residual factors for significantly intense reflections | 0.1339 |
Weighted residual factors for all reflections included in the refinement | 0.1423 |
Goodness-of-fit parameter for all reflections included in the refinement | 0.999 |
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/4065333.html
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Users of the data should acknowledge the original authors of the
structural data.