Crystallography Open Database
- COD Home
- Accessing COD Data
- Add Your Data
- Documentation
Information card for entry 4348369
Preview
| Coordinates | 4348369.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C73 H73 Cl Gd2 N20 O45 |
|---|---|
| Calculated formula | C73 H73 Cl Gd2 N20 O45 |
| Title of publication | Guest dependent reversible single-crystal to single-crystal structural transformation in a flexible Gd(iii)-coordination polymer |
| Authors of publication | Pal, Tapan K.; De, Dinesh; Neogi, Subhadip; Bharadwaj, Parimal K. |
| Journal of publication | Inorganic Chemistry Frontiers |
| Year of publication | 2015 |
| Journal volume | 2 |
| Journal issue | 4 |
| Pages of publication | 395 |
| a | 13.137 ± 0.005 Å |
| b | 30.227 ± 0.005 Å |
| c | 23.326 ± 0.005 Å |
| α | 90° |
| β | 102.075 ± 0.005° |
| γ | 90° |
| Cell volume | 9058 ± 4 Å3 |
| Cell temperature | 100 ± 2 K |
| Ambient diffraction temperature | 100 ± 2 K |
| Number of distinct elements | 6 |
| 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 | 0.0599 |
| Residual factor for significantly intense reflections | 0.0445 |
| Weighted residual factors for significantly intense reflections | 0.1051 |
| Weighted residual factors for all reflections included in the refinement | 0.1137 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.042 |
| Diffraction radiation wavelength | 0.71069 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 232891 (current) | 2019-11-23 | cif/ Adding structures of 4348368, 4348369, 4348370, 4348371 via cif-deposit CGI script. |
4348369.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.