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Information card for entry 2236624
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| Coordinates | 2236624.cif |
|---|---|
| Structure factors | 2236624.hkl |
| Original IUCr paper | HTML |
| Chemical name | Poly[(μ~3~-hydrogenphosphato)(4<i>H</i>-1,2,4-triazole-κ<i>N</i>^1^)zinc] |
|---|---|
| Formula | C2 H4 N3 O4 P Zn |
| Calculated formula | C2 H4 N3 O4 P Zn |
| Title of publication | Poly[(μ~3~-hydrogenphosphato)(4<i>H</i>-1,2,4-triazole-κ<i>N</i>^1^)zinc] |
| Authors of publication | Aitenneite, Hafid; El Bouari, Abdeslam; Sebti, Said; Saadi, Mohamed; El Ammari, Lahcen; Adil, Karim |
| Journal of publication | Acta Crystallographica Section E |
| Year of publication | 2012 |
| Journal volume | 68 |
| Journal issue | 11 |
| Pages of publication | m1426 - m1427 |
| a | 8.5467 ± 0.0013 Å |
| b | 8.4344 ± 0.0012 Å |
| c | 8.9674 ± 0.0013 Å |
| α | 90° |
| β | 90° |
| γ | 90° |
| Cell volume | 646.43 ± 0.16 Å3 |
| Cell temperature | 296 ± 2 K |
| Ambient diffraction temperature | 296 ± 2 K |
| Number of distinct elements | 6 |
| Space group number | 29 |
| Hermann-Mauguin space group symbol | P c a 21 |
| Hall space group symbol | P 2c -2ac |
| Residual factor for all reflections | 0.0218 |
| Residual factor for significantly intense reflections | 0.021 |
| Weighted residual factors for significantly intense reflections | 0.0508 |
| Weighted residual factors for all reflections included in the refinement | 0.0511 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.035 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | Yes |
| Revision | Date | Message | Files |
|---|---|---|---|
| 181288 (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 2/23/66. |
2236624.cif 2236624.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. |
2236624.cif 2236624.hkl |
| 120072 | 2014-07-11 | Adding DOIs to range 2 structures. | 2236624.cif 2236624.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. | 2236624.cif 2236624.hkl |
| 74188 | 2013-02-22 | hkl/ Adding the rest of the Fobs data for the structures publishe din the IUCr journals in 2012 and in January of 2013. |
2236624.cif 2236624.hkl |
| 70210 | 2012-12-21 | cif/ Adding structures of 2236624 via cif-deposit CGI script. |
2236624.cif |
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Users of the data should acknowledge the original authors of the
structural data.