Crystallography Open Database
- COD Home
- Accessing COD Data
- Add Your Data
- Documentation
Information card for entry 7132208
Preview
| Coordinates | 7132208.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Common name | Ferrocenyl |
|---|---|
| Chemical name | 2,2'-(Sulfinylbis(anthracene-10,9-diyl))diferrocene |
| Formula | C48 H34 Fe2 O S |
| Calculated formula | C48 H34 Fe2 O S |
| Title of publication | The unexpected effect of ferrocenyl substituents on the photochemistry of dianthryl sulfoxides. |
| Authors of publication | Removski, Nicole; Wolf, Michael O. |
| Journal of publication | Chemical communications (Cambridge, England) |
| Year of publication | 2023 |
| a | 10.591 ± 0.006 Å |
| b | 42.48 ± 0.03 Å |
| c | 15.387 ± 0.008 Å |
| α | 90° |
| β | 90° |
| γ | 90° |
| Cell volume | 6923 ± 7 Å3 |
| Cell temperature | 173 ± 2 K |
| Ambient diffraction temperature | 173 ± 2 K |
| Number of distinct elements | 5 |
| Space group number | 20 |
| Hermann-Mauguin space group symbol | C 2 2 21 |
| Hall space group symbol | C 2c 2 |
| Residual factor for all reflections | 0.0979 |
| Residual factor for significantly intense reflections | 0.0776 |
| Weighted residual factors for significantly intense reflections | 0.1778 |
| Weighted residual factors for all reflections included in the refinement | 0.1902 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.093 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 286962 (current) | 2023-10-14 | cif/ Adding structures of 7132208, 7132209 via cif-deposit CGI script. |
7132208.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.