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Information card for entry 1567420
Preview
| Coordinates | 1567420.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C96 H136 Al2 Fe2 N4 |
|---|---|
| Calculated formula | C96 H136 Al2 Fe2 N4 |
| Title of publication | Stepwise reduction of a base-stabilised ferrocenyl aluminium(iii) dihalide for the synthesis of structurally-diverse dialane species |
| Authors of publication | Dhara, Debabrata; Fantuzzi, Felipe; Härterich, Marcel; Dewhurst, Rian D.; Krummenacher, Ivo; Arrowsmith, Merle; Pranckevicius, Conor; Braunschweig, Holger |
| Journal of publication | Chemical Science |
| Year of publication | 2022 |
| Journal volume | 13 |
| Journal issue | 33 |
| Pages of publication | 9693 - 9700 |
| a | 15.996 ± 0.008 Å |
| b | 29.021 ± 0.014 Å |
| c | 19.433 ± 0.01 Å |
| α | 90° |
| β | 91.562 ± 0.013° |
| γ | 90° |
| Cell volume | 9018 ± 8 Å3 |
| Cell temperature | 100 ± 2 K |
| Ambient diffraction temperature | 296 ± 2 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 | 0.0833 |
| Residual factor for significantly intense reflections | 0.059 |
| Weighted residual factors for significantly intense reflections | 0.1457 |
| Weighted residual factors for all reflections included in the refinement | 0.1596 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.057 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 277663 (current) | 2022-09-06 | cif/ Updating files of 1567415, 1567416, 1567417, 1567418, 1567419, 1567420, 1567421 Original log message: Adding full bibliography for 1567415--1567421.cif. |
1567420.cif |
| 277027 | 2022-08-02 | cif/ Adding structures of 1567415, 1567416, 1567417, 1567418, 1567419, 1567420, 1567421 via cif-deposit CGI script. |
1567420.cif |
All data in the COD and the database itself are dedicated to the
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Users of the data should acknowledge the original authors of the
structural data.