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Information card for entry 4071151
Preview
Coordinates | 4071151.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C29 H27 O7 P W |
---|---|
Calculated formula | C29 H27 O7 P W |
SMILES | [W]([P@@]12O[C@@H]([C@@]3([C@]([C@H]2c2ccccc2)([C@](O1)(C(=C3C)C)C)C)C)c1ccccc1)(C#[O])(C#[O])(C#[O])(C#[O])C#[O].[W]([P@]12O[C@H]([C@]3([C@@]([C@@H]2c2ccccc2)([C@@](O1)(C(=C3C)C)C)C)C)c1ccccc1)(C#[O])(C#[O])(C#[O])(C#[O])C#[O] |
Title of publication | Synthesis of Novel O,P,C-Cage Complexes via Thermal C−O Ring Opening of an Oxaphosphirane W(CO)5Complex |
Authors of publication | Bode, Maren; Schnakenburg, Gregor; Jones, Peter G.; Streubel, Rainer |
Journal of publication | Organometallics |
Year of publication | 2008 |
Journal volume | 27 |
Journal issue | 11 |
Pages of publication | 2664 |
a | 8.8233 ± 0.0008 Å |
b | 10.726 ± 0.001 Å |
c | 15.0798 ± 0.0014 Å |
α | 92.218 ± 0.004° |
β | 105.029 ± 0.004° |
γ | 93.583 ± 0.004° |
Cell volume | 1373.4 ± 0.2 Å3 |
Cell temperature | 133 ± 2 K |
Ambient diffraction temperature | 133 ± 2 K |
Number of distinct elements | 5 |
Space group number | 2 |
Hermann-Mauguin space group symbol | P -1 |
Hall space group symbol | -P 1 |
Residual factor for all reflections | 0.0169 |
Residual factor for significantly intense reflections | 0.0152 |
Weighted residual factors for significantly intense reflections | 0.0369 |
Weighted residual factors for all reflections included in the refinement | 0.0375 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.035 |
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/4071151.html
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Users of the data should acknowledge the original authors of the
structural data.