Crystallography Open Database
- COD Home
- Accessing COD Data
- Add Your Data
- Documentation
Information card for entry 2227891
Preview
| Coordinates | 2227891.cif |
|---|---|
| Structure factors | 2227891.hkl |
| Original IUCr paper | HTML |
| Chemical name | Poly[(acetato-κ^2^<i>O</i>,<i>O</i>')aqua(μ~4~-1<i>H</i>- benzimidazole-5,6-dicarboxylato- κ^5^<i>N</i>^3^:<i>O</i>^5^,<i>O</i>^5'^:<i>O</i>^5^,<i>O</i>^6^: <i>O</i>^6'^)praseodymium(III)] |
|---|---|
| Formula | C11 H9 N2 O7 Pr |
| Calculated formula | C11 H9 N2 O7 Pr |
| Title of publication | Poly[(acetato-κ^2^<i>O</i>,<i>O</i>')aqua(μ~4~-1<i>H</i>-benzimidazole-5,6-dicarboxylato-κ^5^<i>N</i>^3^:<i>O</i>^5^,<i>O</i>^5'^:<i>O</i>^5^,<i>O</i>^6^:<i>O</i>^6'^)praseodymium(III)] |
| Authors of publication | Pan, Zi-Yu; Chen, Jin-Hua; Lin, Jian-Fen; Xu, Xuan; Luo, Yi-Fan |
| Journal of publication | Acta Crystallographica Section E |
| Year of publication | 2010 |
| Journal volume | 66 |
| Journal issue | 10 |
| Pages of publication | m1302 |
| a | 7.4284 ± 0.0005 Å |
| b | 9.0109 ± 0.0007 Å |
| c | 9.7239 ± 0.0007 Å |
| α | 87.075 ± 0.001° |
| β | 86.498 ± 0.001° |
| γ | 84.274 ± 0.001° |
| Cell volume | 645.77 ± 0.08 Å3 |
| Cell temperature | 296 ± 2 K |
| Ambient diffraction temperature | 296 ± 2 K |
| Number of distinct elements | 5 |
| Space group number | 2 |
| Hermann-Mauguin space group symbol | P -1 |
| Hall space group symbol | -P 1 |
| Residual factor for all reflections | 0.0287 |
| Residual factor for significantly intense reflections | 0.0277 |
| Weighted residual factors for significantly intense reflections | 0.0714 |
| Weighted residual factors for all reflections included in the refinement | 0.0723 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.044 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | Yes |
For the version history of this entry, please navigate to main COD server.
The link is: https://www.crystallography.net/2227891.html
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.