Crystallography Open Database
- COD Home
- Accessing COD Data
- Add Your Data
- Documentation
Information card for entry 7718905
Preview
| Coordinates | 7718905.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C111 H116 Al B F20 Fe2 O |
|---|---|
| Calculated formula | C111 H116 Al B F20 Fe2 O |
| Title of publication | Structural Characterization of a Dicoordinated Bis(ferrocenyl)aluminum Cation |
| Authors of publication | Anzai, Togo; Sugamata, Koh; Morisako, Shogo; Sasamori, Takahiro |
| Journal of publication | Dalton Transactions |
| Year of publication | 2025 |
| a | 12.1792 ± 0.0004 Å |
| b | 29.2404 ± 0.0008 Å |
| c | 27.8811 ± 0.0009 Å |
| α | 90° |
| β | 92.846 ± 0.003° |
| γ | 90° |
| Cell volume | 9916.9 ± 0.5 Å3 |
| Cell temperature | 103 ± 2 K |
| Ambient diffraction temperature | 103 ± 2 K |
| Number of distinct elements | 7 |
| 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 | 0.2045 |
| Residual factor for significantly intense reflections | 0.1022 |
| Weighted residual factors for significantly intense reflections | 0.1336 |
| Weighted residual factors for all reflections included in the refinement | 0.164 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.059 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 300088 (current) | 2025-06-15 | cif/ Adding structures of 7718900, 7718901, 7718902, 7718903, 7718904, 7718905 via cif-deposit CGI script. |
7718905.cif |
All data in the COD and the database itself are dedicated to the
public domain and licensed under the
CC0
License
.
Users of the data should acknowledge the original authors of the
structural data.