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Information card for entry 7063019
Preview
| Coordinates | 7063019.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C34 H43 B Fe P Sb |
|---|---|
| Calculated formula | C34 H43 B Fe P Sb |
| SMILES | [Fe]12345678([c]9([cH]1[cH]2[cH]3[cH]49)[Sb](c1ccccc1)c1ccccc1)[c]1([cH]5[cH]6[cH]7[cH]81)[P]([BH3])(C1CCCCC1)C1CCCCC1 |
| Title of publication | Synthesis, reactivity and coordination behaviour of a ferrocene phosphinostibine and intramolecular interactions in its P(v) and Sb(v) derivatives |
| Authors of publication | Antala, Jakub; Schulz, Jiří; Císařová, Ivana; Štěpnička, Petr |
| Journal of publication | New Journal of Chemistry |
| Year of publication | 2024 |
| Journal volume | 48 |
| Journal issue | 12 |
| Pages of publication | 5107 - 5119 |
| a | 7.5644 ± 0.0003 Å |
| b | 13.3295 ± 0.0005 Å |
| c | 15.4143 ± 0.0006 Å |
| α | 100.986 ± 0.001° |
| β | 90.313 ± 0.001° |
| γ | 92.652 ± 0.001° |
| Cell volume | 1523.94 ± 0.1 Å3 |
| Cell temperature | 120 ± 2 K |
| Ambient diffraction temperature | 120 ± 2 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 | 0.0444 |
| Residual factor for significantly intense reflections | 0.031 |
| Weighted residual factors for significantly intense reflections | 0.0694 |
| Weighted residual factors for all reflections included in the refinement | 0.0746 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.024 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 291034 (current) | 2024-04-05 | cif/ Updating files of 7063018, 7063019, 7063020, 7063021, 7063022, 7063023, 7063024, 7063025, 7063026, 7063027, 7063028, 7063029, 7063030, 7063031, 7063032, 7063033, 7063034 Original log message: Adding full bibliography for 7063018--7063034.cif. |
7063019.cif |
| 289854 | 2024-02-17 | cif/ Adding structures of 7063018, 7063019, 7063020, 7063021, 7063022, 7063023, 7063024, 7063025, 7063026, 7063027, 7063028, 7063029, 7063030, 7063031, 7063032, 7063033, 7063034 via cif-deposit CGI script. |
7063019.cif |
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Users of the data should acknowledge the original authors of the
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