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Information card for entry 8103003
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| Coordinates | 8103003.cif |
|---|
| Formula | Co H12 Na2 O18 P4 |
|---|---|
| Calculated formula | Co0.5 H11 Na O16 P4 |
| Title of publication | Crystal structure of sodium cobalt (II)tetraaquabis(dihydrogendiphosphate), Na2Co(H2P2O7)2(H2O)4 |
| Authors of publication | Sofiane Souissi; Wajda Smirani; Mohamed Rzaigui |
| Journal of publication | Zeitschrift für Kristallographie - New Crystal Structures |
| Year of publication | 2009 |
| Journal volume | 224 |
| Journal issue | 1 |
| Pages of publication | 3 |
| a | 8.034 ± 0.002 Å |
| b | 11.552 ± 0.002 Å |
| c | 9.061 ± 0.002 Å |
| α | 90° |
| β | 113.06 ± 0.02° |
| γ | 90° |
| Cell volume | 773.7 ± 0.3 Å3 |
| Cell temperature | 296.2 K |
| Ambient diffraction temperature | 296.2 K |
| Number of distinct elements | 5 |
| Space group number | 11 |
| Hermann-Mauguin space group symbol | P 1 21/m 1 |
| Hall space group symbol | -P 2yb |
| Residual factor for all reflections | 0.0333 |
| Residual factor for significantly intense reflections | 0.033 |
| Weighted residual factors for all reflections | 0.044 |
| Weighted residual factors for all reflections included in the refinement | 0.044 |
| Goodness-of-fit parameter for all reflections | 1.597 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.6 |
| Diffraction radiation wavelength | 0.7107 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 291193 (current) | 2024-04-15 | cif/8: Fixing Z values and formulae |
8103003.cif |
| 193981 | 2017-03-05 | cod/ (antanas@kurmis) Correcting misspelt data item names by using the 'cod_correct_tags' script and the replacement file 'data/replacement-values/replacement_tags.lst' from the cod-tools repository (rev. 5006). The correction was mainly focused on removing misspelt versions of the '_geom_*' data items. |
8103003.cif |
| 192837 | 2017-03-03 | cif/8/10/ (antanas@echidna.ibt.lt) Changing the values of the '_atom_site_label' and related data items (e. g. '_atom_site_aniso_label') to match each other in order to relate data from different loops in entries 8100069, 8100127, 8101029, 8101576, 8101706, 8101716, 8101760, 8101761, 8101767, 8103003. |
8103003.cif |
| 176466 | 2016-02-16 | cif/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in range 8. |
8103003.cif |
| 35911 | 2012-02-28 | cif/ Reorganising ranges 1, 3, 5, 6 and 8 into a prefix-directory tree. |
8103003.cif |
| 13742 | 2011-03-06 | ../uploads/cif-deposit/cod/cif Adding structures of 8103003 via cif-deposit CGI script. |
8103003.cif |
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Users of the data should acknowledge the original authors of the
structural data.