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Information card for entry 4517613
Preview
Coordinates | 4517613.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C40.9 H35.8 Cl1.8 F3 O3 P S |
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Calculated formula | C40.9 H35.8 Cl1.8 F3 O3 P S |
Title of publication | Expanding Ligand Space: Preparation, Characterization, and Synthetic Applications of Air-Stable, Odorless Di-tert-alkylphosphine Surrogates |
Authors of publication | Barber, Thomas; Argent, Stephen P.; Ball, Liam T. |
Journal of publication | ACS Catalysis |
Year of publication | 2020 |
Pages of publication | 5454 - 5461 |
a | 11.5515 ± 0.0002 Å |
b | 18.5889 ± 0.0002 Å |
c | 17.7571 ± 0.0002 Å |
α | 90° |
β | 99.907 ± 0.001° |
γ | 90° |
Cell volume | 3756.12 ± 0.09 Å3 |
Cell temperature | 120 ± 2 K |
Ambient diffraction temperature | 120 ± 2 K |
Number of distinct elements | 7 |
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 | 0.0726 |
Residual factor for significantly intense reflections | 0.0701 |
Weighted residual factors for significantly intense reflections | 0.1794 |
Weighted residual factors for all reflections included in the refinement | 0.1818 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.026 |
Diffraction radiation probe | x-ray |
Diffraction radiation wavelength | 1.54184 Å |
Diffraction radiation type | CuKα |
Has coordinates | Yes |
Has disorder | Yes |
Has Fobs | No |
For the version history of this entry, please navigate to main COD server.
The link is: https://www.crystallography.net/4517613.html
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