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Information card for entry 2023038
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| Coordinates | 2023038.cif |
|---|---|
| Structure factors | 2023038.hkl |
| Original IUCr paper | HTML |
| Common name | Bis[1-oxopyridin-2-olato(1-)]bis(pentafluorophenyl)silicon(IV)–tetrahydrofuran–pentane (2/1/1) |
|---|---|
| Chemical name | Bis[1-oxopyridin-2-olato(1-)]bis(pentafluorophenyl)silicon(IV)–tetrahydrofuran–pentane (2/1/1) |
| Formula | C26.5 H18 F10 N2 O4.5 Si |
| Calculated formula | C26.5 H18 F10 N2 O4.5 Si |
| Title of publication | Synthesis and crystal structures of bis-[1-oxopyridin-2-olato(1-)]bis-(penta-fluoro-phen-yl)silicon(IV)-tetra-hydro-furan-pentane (2/1/1), bis-[1-oxopyridin-2-olato(1-)]bis-(<i>p</i>-tol-yl)silicon(IV), and dimesitylbis[1-oxopyridin-2-olato(1-)]silicon(IV). |
| Authors of publication | Kraft, Bradley M.; Brennessel, William W.; Andrews, Jordan W.; Viggiani, Michael T.; Kittrell, Nathan F.; Heckman, Matthew T. |
| Journal of publication | Acta crystallographica. Section E, Crystallographic communications |
| Year of publication | 2024 |
| Journal volume | 80 |
| Journal issue | Pt 3 |
| Pages of publication | 318 - 324 |
| a | 12.6809 ± 0.0009 Å |
| b | 12.1217 ± 0.0009 Å |
| c | 17.7335 ± 0.0013 Å |
| α | 90° |
| β | 105.767 ± 0.0015° |
| γ | 90° |
| Cell volume | 2623.3 ± 0.3 Å3 |
| Cell temperature | 100 ± 0.5 K |
| Ambient diffraction temperature | 100 ± 0.5 K |
| Number of distinct elements | 6 |
| 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 | 0.0817 |
| Residual factor for significantly intense reflections | 0.0513 |
| Weighted residual factors for significantly intense reflections | 0.1448 |
| Weighted residual factors for all reflections included in the refinement | 0.1629 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.033 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | Yes |
| Revision | Date | Message | Files |
|---|---|---|---|
| 291115 (current) | 2024-04-06 | cif/ Updating files of 2023038, 2023039, 2023040 Original log message: Adding full bibliography for 2023038--2023040.cif. |
2023038.cif 2023038.hkl |
| 289908 | 2024-02-21 | cif/ hkl/ Adding structures of 2023038, 2023039, 2023040 via cif-deposit CGI script. |
2023038.cif 2023038.hkl |
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Users of the data should acknowledge the original authors of the
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