Crystallography Open Database
- COD Home
- Accessing COD Data
- Add Your Data
- Documentation
Information card for entry 7239850
Preview
| Coordinates | 7239850.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C7 H6 B Na O5 |
|---|---|
| Calculated formula | C7 H4 B Na O5 |
| Title of publication | A new series of lanthanide-based complexes with a bis(hydroxy)benzoxaborolone ligand: synthesis, crystal structure, and magnetic and optical properties |
| Authors of publication | Abdallah, Ahmad; Puget, Marin; Daiguebonne, Carole; Suffren, Yan; Calvez, Guillaume; Bernot, Kevin; Guillou, Olivier |
| Journal of publication | CrystEngComm |
| Year of publication | 2020 |
| Journal volume | 22 |
| Journal issue | 11 |
| Pages of publication | 2020 - 2030 |
| a | 4.5881 ± 0.0013 Å |
| b | 6.5905 ± 0.0016 Å |
| c | 29.664 ± 0.008 Å |
| α | 90° |
| β | 90° |
| γ | 90° |
| Cell volume | 897 ± 0.4 Å3 |
| Cell temperature | 150 ± 2 K |
| Ambient diffraction temperature | 150 ± 2 K |
| Number of distinct elements | 5 |
| Space group number | 19 |
| Hermann-Mauguin space group symbol | P 21 21 21 |
| Hall space group symbol | P 2ac 2ab |
| Residual factor for all reflections | 0.0539 |
| Residual factor for significantly intense reflections | 0.0487 |
| Weighted residual factors for significantly intense reflections | 0.1378 |
| Weighted residual factors for all reflections included in the refinement | 0.1404 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.022 |
| Diffraction radiation probe | x-ray |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 257485 (current) | 2020-10-06 | cif/ Updating files of 7239849, 7239850 Original log message: Adding full bibliography for 7239849--7239850.cif. |
7239850.cif |
| 250268 | 2020-04-05 | cif/ Updating files of 7239849, 7239850 Original log message: Adding full bibliography for 7239849--7239850.cif. |
7239850.cif |
| 247400 | 2020-01-31 | cif/ Adding structures of 7239849, 7239850 via cif-deposit CGI script. |
7239850.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.