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Information card for entry 7248499
Preview
| Coordinates | 7248499.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C16 H37 O4 P S |
|---|---|
| Calculated formula | C16 H37 O4 P S |
| Title of publication | Synthesis and structural trends in a series of simple tetraalkylphosphonium salts |
| Authors of publication | Gawraczyński, Jakub; Leszczyński, Piotr J.; Cyrański, Michał K.; Dobrzycki, Łukasz; Koźmiński, Wiktor; Fijałkowski, Karol J.; Grochala, Wojciech; Jaroń, Tomasz |
| Journal of publication | CrystEngComm |
| Year of publication | 2024 |
| Journal volume | 26 |
| Journal issue | 20 |
| Pages of publication | 2673 - 2682 |
| a | 13.7521 ± 0.0002 Å |
| b | 22.0007 ± 0.0003 Å |
| c | 13.9604 ± 0.0002 Å |
| α | 90° |
| β | 105.595 ± 0.002° |
| γ | 90° |
| Cell volume | 4068.31 ± 0.11 Å3 |
| Cell temperature | 100 K |
| Ambient diffraction temperature | 100 K |
| Number of distinct elements | 5 |
| Space group number | 14 |
| Hermann-Mauguin space group symbol | P 1 21/n 1 |
| Hall space group symbol | -P 2yn |
| Residual factor for all reflections | 0.071 |
| Residual factor for significantly intense reflections | 0.063 |
| Weighted residual factors for significantly intense reflections | 0.1532 |
| Weighted residual factors for all reflections included in the refinement | 0.1594 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.0448 |
| Diffraction radiation probe | x-ray |
| Diffraction radiation wavelength | 1.54184 Å |
| Diffraction radiation type | CuKα |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 292968 (current) | 2024-07-05 | cif/ Updating files of 7248499, 7248500, 7248501, 7248502, 7248503, 7248504, 7248505, 7248506, 7248507, 7248508, 7248509 Original log message: Adding full bibliography for 7248499--7248509.cif. |
7248499.cif |
| 291322 | 2024-04-23 | cif/ Adding structures of 7248499, 7248500, 7248501, 7248502, 7248503, 7248504, 7248505, 7248506, 7248507, 7248508, 7248509 via cif-deposit CGI script. |
7248499.cif |
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Users of the data should acknowledge the original authors of the
structural data.