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Information card for entry 4087213
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Coordinates | 4087213.cif |
---|---|
Original paper (by DOI) | HTML |
Chemical name | AS-31 |
---|---|
Formula | C27 H24 N O5 P W |
Calculated formula | C27 H24 N O5 P W |
SMILES | [W]([P](N(C)C)(C)C(c1ccccc1)(c1ccccc1)c1ccccc1)(C#[O])(C#[O])(C#[O])(C#[O])C#[O] |
Title of publication | 1,1′-Bifunctional Aminophosphane Complexes via N‒H Bond Insertions of a Li/Cl Phosphinidenoid Complex and First Studies on N/P Mono Functionalizations |
Authors of publication | Streubel, Rainer; Schmer, Alexander; Kyri, Andreas W.; Schnakenburg, Gregor |
Journal of publication | Organometallics |
Year of publication | 2017 |
a | 10.5144 ± 0.0006 Å |
b | 15.2601 ± 0.001 Å |
c | 16.9086 ± 0.0011 Å |
α | 105.035 ± 0.002° |
β | 102.792 ± 0.002° |
γ | 91.822 ± 0.002° |
Cell volume | 2543.6 ± 0.3 Å3 |
Cell temperature | 123 K |
Ambient diffraction temperature | 123 K |
Number of distinct elements | 6 |
Space group number | 2 |
Hermann-Mauguin space group symbol | P -1 |
Hall space group symbol | -P 1 |
Residual factor for all reflections | 0.0249 |
Residual factor for significantly intense reflections | 0.0182 |
Weighted residual factors for significantly intense reflections | 0.0385 |
Weighted residual factors for all reflections included in the refinement | 0.0416 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.099 |
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/4087213.html
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Users of the data should acknowledge the original authors of the
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