Crystallography Open Database
- COD Home
- Accessing COD Data
- Add Your Data
- Documentation
Information card for entry 8107219
Preview
| Coordinates | 8107219.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C20 H15 Mn N3 O5 |
|---|---|
| Calculated formula | C20 H15 Mn N3 O5 |
| Title of publication | Crystal structure of catena-poly[qua-(μ2-2-aminoisophthalat-κ3 O,O′:O′′)(1,10-phenanthroline-κ2 N,N′)manganese(II)] C20H15MnN3O5 |
| Authors of publication | Huang, Guang; Chen, Xinyun |
| Journal of publication | Zeitschrift für Kristallographie - New Crystal Structures |
| Year of publication | 2022 |
| Journal volume | 237 |
| Journal issue | 5 |
| Pages of publication | 797 - 799 |
| a | 10.0223 ± 0.0005 Å |
| b | 9.3406 ± 0.0005 Å |
| c | 18.6978 ± 0.001 Å |
| α | 90° |
| β | 99.322 ± 0.006° |
| γ | 90° |
| Cell volume | 1727.27 ± 0.16 Å3 |
| Cell temperature | 249.99 ± 0.1 K |
| Ambient diffraction temperature | 249.99 ± 0.1 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 | 0.0502 |
| Residual factor for significantly intense reflections | 0.0376 |
| Weighted residual factors for significantly intense reflections | 0.0794 |
| Weighted residual factors for all reflections included in the refinement | 0.0873 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.03 |
| 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 |
|---|---|---|---|
| 283821 (current) | 2023-05-17 | cif/ Adding structures of 8107219 via cif-deposit CGI script. |
8107219.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.