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Information card for entry 2238478
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| Coordinates | 2238478.cif |
|---|---|
| Structure factors | 2238478.hkl |
| Original IUCr paper | HTML |
| Chemical name | Diaquadichloridobis(pyridine-κ<i>N</i>)cobalt(II) |
|---|---|
| Formula | C10 H14 Cl2 Co N2 O2 |
| Calculated formula | C10 H14 Cl2 Co N2 O2 |
| SMILES | c1cccc[n]1[Co]([OH2])([n]1ccccc1)([OH2])(Cl)Cl |
| Title of publication | Diaquadichloridobis(pyridine-κ<i>N</i>)cobalt(II) |
| Authors of publication | Kannan, P.S.; Ganeshraja, A. S.; Anbalagan, K.; Govindan, E.; SubbiahPandi, A. |
| Journal of publication | Acta Crystallographica Section E |
| Year of publication | 2013 |
| Journal volume | 69 |
| Journal issue | 9 |
| Pages of publication | m508 - m509 |
| a | 6.2028 ± 0.0002 Å |
| b | 6.5971 ± 0.0001 Å |
| c | 8.5963 ± 0.0002 Å |
| α | 109.734 ± 0.002° |
| β | 102.621 ± 0.003° |
| γ | 97.031 ± 0.002° |
| Cell volume | 315.649 ± 0.015 Å3 |
| Cell temperature | 293 ± 2 K |
| Ambient diffraction temperature | 293 ± 2 K |
| Number of distinct elements | 6 |
| Space group number | 2 |
| Hermann-Mauguin space group symbol | P -1 |
| Hall space group symbol | -P 1 |
| Residual factor for all reflections | 0.0518 |
| Residual factor for significantly intense reflections | 0.0474 |
| Weighted residual factors for significantly intense reflections | 0.1462 |
| Weighted residual factors for all reflections included in the refinement | 0.1494 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.157 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | Yes |
| Revision | Date | Message | Files |
|---|---|---|---|
| 181306 (current) | 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 2/23/84. |
2238478.cif 2238478.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. |
2238478.cif 2238478.hkl |
| 89416 | 2013-10-25 | cif/ (saulius@koala.ibt.lt) Adding links pointing to FOBS data to the recently deposited structures from IUCr. |
2238478.cif 2238478.hkl |
| 89414 | 2013-10-24 | cod/ (saulius@koala.ibt.lt) Adding FOBS data for the recently deposited IUCr structures. |
2238478.cif 2238478.hkl |
| 88604 | 2013-10-02 | cif/ Adding structures of 2238478 via cif-deposit CGI script. |
2238478.cif |
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Users of the data should acknowledge the original authors of the
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