Crystallography Open Database
- COD Home
- Accessing COD Data
- Add Your Data
- Documentation
Information card for entry 2013823
Preview
| Coordinates | 2013823.cif |
|---|---|
| Original IUCr paper | HTML |
| Chemical name | catena-Poly[[silver(I)-μ-ethane-1,2-diamine-κ^2^N:N'] 3-fluorobenzoate monohydrate] |
|---|---|
| Formula | C9 H14 Ag F N2 O3 |
| Calculated formula | C9 H14 Ag F N2 O3 |
| SMILES | [Ag]([NH2]CCN)[NH2]CC[NH2][Ag].Fc1cccc(c1)C(=O)[O-].O.Fc1cccc(c1)C(=O)[O-].O |
| Title of publication | <i>catena</i>-Poly[[silver(I)-μ-ethane-1,2-diamine-κ^2^<i>N</i>:<i>N</i>'] 3-fluorobenzoate monohydrate] |
| Authors of publication | You, Zhong-Lu; Yang, Li; Zou, Ying; Zeng, Wei-Jie; Liu, Wei-Sheng; Zhu, Hai-Liang |
| Journal of publication | Acta Crystallographica Section C |
| Year of publication | 2004 |
| Journal volume | 60 |
| Journal issue | 3 |
| Pages of publication | m117 - m118 |
| a | 23.721 ± 0.005 Å |
| b | 7.18 ± 0.001 Å |
| c | 13.961 ± 0.003 Å |
| α | 90° |
| β | 100.45 ± 0.03° |
| γ | 90° |
| Cell volume | 2338.4 ± 0.8 Å3 |
| Cell temperature | 293 ± 2 K |
| Ambient diffraction temperature | 293 ± 2 K |
| Number of distinct elements | 6 |
| Space group number | 15 |
| Hermann-Mauguin space group symbol | C 1 2/c 1 |
| Hall space group symbol | -C 2yc |
| Residual factor for all reflections | 0.0507 |
| Residual factor for significantly intense reflections | 0.04 |
| Weighted residual factors for significantly intense reflections | 0.0864 |
| Weighted residual factors for all reflections included in the refinement | 0.0912 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.072 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
For the version history of this entry, please navigate to main COD server.
The link is: https://www.crystallography.net/2013823.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.