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Information card for entry 4083217
Preview
Coordinates | 4083217.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C17 H13 O10 P W |
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Calculated formula | C17 H13 O10 P W |
SMILES | [W](C#[O])(C#[O])(C#[O])(C#[O])(C#[O])[P@@]1(C)C(=O)[C@H]2C=C[C@@H]1C(=C2C(=O)OC)C(=O)OC.[W](C#[O])(C#[O])(C#[O])(C#[O])(C#[O])[P@]1(C)C(=O)[C@@H]2C=C[C@H]1C(=C2C(=O)OC)C(=O)OC |
Title of publication | Generation and Reactivity of Methylphosphaketene in the Coordination Sphere of Tungsten |
Authors of publication | Mao, Yanli; Wang, Zhiyue; Ganguly, Rakesh; Mathey, François |
Journal of publication | Organometallics |
Year of publication | 2012 |
Journal volume | 31 |
Journal issue | 13 |
Pages of publication | 4786 |
a | 11.5045 ± 0.0004 Å |
b | 25.1151 ± 0.0009 Å |
c | 6.8545 ± 0.0002 Å |
α | 90° |
β | 92.643 ± 0.001° |
γ | 90° |
Cell volume | 1978.41 ± 0.11 Å3 |
Cell temperature | 103 ± 2 K |
Ambient diffraction temperature | 103 ± 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 | 0.0584 |
Residual factor for significantly intense reflections | 0.0349 |
Weighted residual factors for significantly intense reflections | 0.0745 |
Weighted residual factors for all reflections included in the refinement | 0.0968 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.017 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
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The link is: https://www.crystallography.net/4083217.html
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Users of the data should acknowledge the original authors of the
structural data.