Crystallography Open Database
- COD Home
- Accessing COD Data
- Add Your Data
- Documentation
Information card for entry 7228692
Preview
| Coordinates | 7228692.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C97 H144 N6 O44 Tb6 |
|---|---|
| Calculated formula | C90 H132 N6 O42 Tb6 |
| Title of publication | A series of six-member lanthanide-rings based on 2,2-bis(hydroxymethyl)-2,2’,2’’-nitrilotriethanol : synthesis, crystal structures and magnetic properties |
| Authors of publication | li, bao; hu, peng; yin, lei; Mao, Nannan; Yu, Fan; Wang, Zhenxing; Zhang, Tianle |
| Journal of publication | CrystEngComm |
| Year of publication | 2017 |
| a | 26.742 ± 0.004 Å |
| b | 26.742 ± 0.004 Å |
| c | 78.391 ± 0.016 Å |
| α | 90° |
| β | 90° |
| γ | 120° |
| Cell volume | 48549 ± 14 Å3 |
| Cell temperature | 293 ± 2 K |
| Ambient diffraction temperature | 293 ± 2 K |
| Number of distinct elements | 5 |
| Space group number | 148 |
| Hermann-Mauguin space group symbol | R -3 |
| Hall space group symbol | -R 3 |
| Residual factor for all reflections | 0.0414 |
| Residual factor for significantly intense reflections | 0.0341 |
| Weighted residual factors for significantly intense reflections | 0.0876 |
| Weighted residual factors for all reflections included in the refinement | 0.0911 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.05 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 198771 (current) | 2017-07-18 | cif/ Adding structures of 7228691, 7228692, 7228693 via cif-deposit CGI script. |
7228692.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.