Crystallography Open Database
- COD Home
- Accessing COD Data
- Add Your Data
- Documentation
Information card for entry 2022535
Preview
| Coordinates | 2022535.cif |
|---|---|
| Structure factors | 2022535.hkl |
| Original IUCr paper | HTML |
| Chemical name | <i>catena</i>-Poly[bis(μ-~3~η^4^:η^6^:η^4^-naphthalene)tetrakis(tetrahydrofuran)dipotassiumvanadium] |
|---|---|
| Formula | C36 H48 K2 O4 V |
| Calculated formula | C36 H48 K2 O4 V |
| Title of publication | Syntheses and crystal structures of new naphthalene– and anthracene–vanadate salts and an unprecedented dimetallabis(anthracene) sandwich complex: [Na(tetrahydrofuran)~3~][V~2~(anthracene)~2~] |
| Authors of publication | Kucera, Benjamin E.; Young, Jr, Victor G.; Brennessel, William W.; Ellis, John E. |
| Journal of publication | Acta Crystallographica Section C |
| Year of publication | 2022 |
| Journal volume | 78 |
| Journal issue | 3 |
| a | 10.985 ± 0.002 Å |
| b | 17.243 ± 0.004 Å |
| c | 18.532 ± 0.004 Å |
| α | 90° |
| β | 101.014 ± 0.003° |
| γ | 90° |
| Cell volume | 3445.6 ± 1.3 Å3 |
| Cell temperature | 173 ± 2 K |
| Ambient diffraction temperature | 173 ± 2 K |
| Number of distinct elements | 5 |
| Space group number | 14 |
| Hermann-Mauguin space group symbol | P 1 21/c 1 |
| Hall space group symbol | -P 2ybc |
| Residual factor for all reflections | 0.0858 |
| Residual factor for significantly intense reflections | 0.0474 |
| Weighted residual factors for significantly intense reflections | 0.1061 |
| Weighted residual factors for all reflections included in the refinement | 0.12 |
| 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 | Yes |
| Has Fobs | Yes |
| Revision | Date | Message | Files |
|---|---|---|---|
| 272899 (current) | 2022-02-10 | cif/ hkl/ Adding structures of 2022535, 2022536, 2022537, 2022538, 2022539, 2022540 via cif-deposit CGI script. |
2022535.cif 2022535.hkl |
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.