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Information card for entry 2018578
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| Coordinates | 2018578.cif |
|---|---|
| Structure factors | 2018578.hkl |
| Original IUCr paper | HTML |
| Chemical name | Potassium calcium diaquacobalt(II) <i>catena</i>-borodiphosphate monohydrate |
|---|---|
| Formula | B Ca0.42 Co H6 K0.17 O11 P2 |
| Calculated formula | B Ca0.418 Co H4 K0.172 O11 P2 |
| Title of publication | KCo(H~2~O)~2~BP~2~O~8~·0.48H~2~O and K~0.17~Ca~0.42~Co(H~2~O)~2~BP~2~O~8~·H~2~O: two cobalt borophosphates with helical ribbons and disordered (K,Ca)/H~2~O schemes |
| Authors of publication | Guesmi, Abderrahmen; Driss, Ahmed |
| Journal of publication | Acta Crystallographica Section C |
| Year of publication | 2012 |
| Journal volume | 68 |
| Journal issue | 8 |
| Pages of publication | i55 - i59 |
| a | 9.472 ± 0.0015 Å |
| b | 9.472 ± 0.0015 Å |
| c | 15.872 ± 0.006 Å |
| α | 90° |
| β | 90° |
| γ | 120° |
| Cell volume | 1233.2 ± 0.5 Å3 |
| Cell temperature | 293 ± 2 K |
| Ambient diffraction temperature | 293 ± 2 K |
| Number of distinct elements | 7 |
| Space group number | 179 |
| Hermann-Mauguin space group symbol | P 65 2 2 |
| Hall space group symbol | P 65 2 (0 0 1) |
| Residual factor for all reflections | 0.029 |
| Residual factor for significantly intense reflections | 0.0261 |
| Weighted residual factors for significantly intense reflections | 0.0684 |
| Weighted residual factors for all reflections included in the refinement | 0.0705 |
| Goodness-of-fit parameter for all reflections included in the refinement | 0.984 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | Yes |
| Revision | Date | Message | Files |
|---|---|---|---|
| 180854 (current) | 2016-04-02 | cif/2/01/ (antanas@echidna) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 2/01/85. |
2018578.cif 2018578.hkl |
| 176432 | 2016-02-14 | cif/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries. |
2018578.cif 2018578.hkl |
| 125873 | 2014-10-25 | cod/ (saulius@koala.ibt.lt) Adding DOIs to 1887 Acta Cryst. CIFs, their DOIs fetched using ACCE codes. |
2018578.cif 2018578.hkl |
| 88064 | 2013-08-29 | Adding _cod_database_fobs_code data item to all COD CIFs that have Fobs deposited and did not have this data item yet. | 2018578.cif 2018578.hkl |
| 66590 | 2012-09-11 | hkl/ Adding assigned .htl files for the most recent IUCr data depositions. |
2018578.cif 2018578.hkl |
| 65981 | 2012-09-06 | cif/ Adding structures of 2018577, 2018578 via cif-deposit CGI script. |
2018578.cif |
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