Crystallography Open Database
- COD Home
- Accessing COD Data
- Add Your Data
- Documentation
Information card for entry 8104801
Preview
| Coordinates | 8104801.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C30 H24 Cd N2 O8 |
|---|---|
| Calculated formula | C30 H24 Cd N2 O8 |
| Title of publication | Crystal structure of poly[aqua-(μ2-1,4-bis(2′-carboxylatophenoxy)benzene-κ2 O:O′)-(μ2-4,4′-bipyridione-κ2 N:N′)cadmium(II)] monhydrate, C30H22CdN2O7⋅H2O |
| Authors of publication | Yang, Bin; Wang, Ai; Wang, Yan |
| Journal of publication | Zeitschrift für Kristallographie - New Crystal Structures |
| Year of publication | 2021 |
| Journal volume | 236 |
| Journal issue | 3 |
| Pages of publication | 685 - 687 |
| a | 11.72 ± 0.002 Å |
| b | 14 ± 0.003 Å |
| c | 16.971 ± 0.003 Å |
| α | 90° |
| β | 90° |
| γ | 90° |
| Cell volume | 2784.6 ± 0.9 Å3 |
| Cell temperature | 293 ± 2 K |
| Ambient diffraction temperature | 293 ± 2 K |
| Number of distinct elements | 5 |
| Space group number | 56 |
| Hermann-Mauguin space group symbol | P c c n |
| Hall space group symbol | -P 2ab 2ac |
| Residual factor for all reflections | 0.0701 |
| Residual factor for significantly intense reflections | 0.0544 |
| Weighted residual factors for significantly intense reflections | 0.1506 |
| Weighted residual factors for all reflections included in the refinement | 0.1664 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.074 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 273801 (current) | 2022-03-18 | cif/ Adding structures of 8104801 via cif-deposit CGI script. |
8104801.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.