Crystallography Open Database
- COD Home
- Accessing COD Data
- Add Your Data
- Documentation
Information card for entry 2239517
Preview
| Coordinates | 2239517.cif |
|---|---|
| Structure factors | 2239517.hkl |
| Original paper (by DOI) | HTML |
| Chemical name | Poly[[diaqua[μ-1,4-bis(pyridin-4-ylmethyl)piperazine-κ^2^<i>N</i>:<i>N</i>']{μ-2,2'-[(1,4-phenylene)bis(oxy)]diacetato-κ^2^<i>O</i>:<i>O</i>'}cobalt(II)] pentahydrate] |
|---|---|
| Formula | C26 H42 Co N4 O13 |
| Calculated formula | C26 H32 Co N4 O8 |
| Title of publication | Poly[[diaqua[μ-1,4-bis(pyridin-4-ylmethyl)piperazine-κ^2^<i>N</i>:<i>N</i>']{μ-2,2'-[(1,4-phenylene)bis(oxy)]diacetato-κ^2^<i>O</i>:<i>O</i>'}cobalt(II)] pentahydrate] |
| Authors of publication | Sample, Alexander D.; LaDuca, Robert L. |
| Journal of publication | Acta Crystallographica Section E |
| Year of publication | 2014 |
| Journal volume | 70 |
| Journal issue | 6 |
| Pages of publication | m198 - m199 |
| a | 5.7727 ± 0.0008 Å |
| b | 10.3421 ± 0.0015 Å |
| c | 13.1675 ± 0.0019 Å |
| α | 87.175 ± 0.002° |
| β | 78.856 ± 0.002° |
| γ | 81.474 ± 0.002° |
| Cell volume | 762.6 ± 0.19 Å3 |
| Cell temperature | 173 ± 2 K |
| Ambient diffraction temperature | 173.15 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 | 0.1397 |
| Residual factor for significantly intense reflections | 0.0925 |
| Weighted residual factors for significantly intense reflections | 0.2018 |
| Weighted residual factors for all reflections included in the refinement | 0.228 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.099 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | Yes |
| Revision | Date | Message | Files |
|---|---|---|---|
| 181895 (current) | 2016-04-06 | hkl/2/23/ (antanas@echidna) Adding IUCr specific svn headers to multiple entries in subrange 2/23/95. |
2239517.cif 2239517.hkl |
| 181314 | 2016-04-03 | hkl/2/23/ (antanas@echidna) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 2/23/95. |
2239517.cif 2239517.hkl |
| 176798 | 2016-02-21 | cif/2/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 2/23. |
2239517.cif 2239517.hkl |
| 113285 | 2014-05-10 | cif/ hkl/ Adding structures of 2239517 via cif-deposit CGI script. |
2239517.cif 2239517.hkl |
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.