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Information card for entry 4080055
Preview
Coordinates | 4080055.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C37 H25 Al Cl4 O5 P2 W |
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Calculated formula | C37 H25 Al Cl4 O5 P2 W |
SMILES | C(#[O])[W](C#[O])(C#[O])(C#[O])(C#[O])[P]1(C(=C1c1ccccc1)c1ccccc1)[P](c1ccccc1)(c1ccccc1)c1ccccc1.[Al](Cl)(Cl)(Cl)[Cl-] |
Title of publication | Facile Phosphorus‒Carbon Bond Formation using a Tungsten-Coordinated Phosphirenyl Cation |
Authors of publication | Jayaraman, Arumugam; Sterenberg, Brian T. |
Journal of publication | Organometallics |
Year of publication | 2013 |
Journal volume | 32 |
Journal issue | 3 |
Pages of publication | 745 |
a | 11.6189 ± 0.001 Å |
b | 11.6227 ± 0.001 Å |
c | 16.3982 ± 0.0014 Å |
α | 93.0368 ± 0.0008° |
β | 102.065 ± 0.0009° |
γ | 117.997 ± 0.0008° |
Cell volume | 1882.6 ± 0.3 Å3 |
Cell temperature | 173 ± 2 K |
Ambient diffraction temperature | 173 ± 2 K |
Number of distinct elements | 7 |
Space group number | 2 |
Hermann-Mauguin space group symbol | P -1 |
Hall space group symbol | -P 1 |
Residual factor for all reflections | 0.0157 |
Residual factor for significantly intense reflections | 0.0151 |
Weighted residual factors for significantly intense reflections | 0.0371 |
Weighted residual factors for all reflections included in the refinement | 0.0374 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.062 |
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/4080055.html
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Users of the data should acknowledge the original authors of the
structural data.