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Information card for entry 4069639
Preview
Coordinates | 4069639.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C30 H30 O10 P2 W2 |
---|---|
Calculated formula | C30 H30 O10 P2 W2 |
SMILES | [W]([P@@]1([P@]2([W](C#[O])(C#[O])(C#[O])(C#[O])C#[O])[C@@]3([C@]1(C(=C(C23C)C)C)C)C)C1(C(=C(C(=C1C)C)C)C)C)(C#[O])(C#[O])(C#[O])(C#[O])C#[O].[W]([P@]1([P@@]2([W](C#[O])(C#[O])(C#[O])(C#[O])C#[O])[C@]3([C@@]1(C(=C(C23C)C)C)C)C)C1(C(=C(C(=C1C)C)C)C)C)(C#[O])(C#[O])(C#[O])(C#[O])C#[O] |
Title of publication | Formation of a Novel P,C-Cage Ligand via aP-C5Me5-Substituted Li/Cl Phosphinidenoid Complex |
Authors of publication | Bode, Maren; Daniels, Jörg; Streubel, Rainer |
Journal of publication | Organometallics |
Year of publication | 2009 |
Journal volume | 28 |
Journal issue | 16 |
Pages of publication | 4636 |
a | 11.9232 ± 0.0003 Å |
b | 14.0356 ± 0.0004 Å |
c | 19.5914 ± 0.0003 Å |
α | 90° |
β | 93.593 ± 0.001° |
γ | 90° |
Cell volume | 3272.16 ± 0.13 Å3 |
Cell temperature | 100 ± 2 K |
Ambient diffraction temperature | 100 ± 2 K |
Number of distinct elements | 5 |
Space group number | 14 |
Hermann-Mauguin space group symbol | P 1 21/n 1 |
Hall space group symbol | -P 2yn |
Residual factor for all reflections | 0.0288 |
Residual factor for significantly intense reflections | 0.0233 |
Weighted residual factors for significantly intense reflections | 0.0437 |
Weighted residual factors for all reflections included in the refinement | 0.045 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.018 |
Diffraction radiation probe | x-ray |
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/4069639.html
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Users of the data should acknowledge the original authors of the
structural data.