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Information card for entry 2241427
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| Coordinates | 2241427.cif |
|---|---|
| Structure factors | 2241427.hkl |
| Original IUCr paper | HTML |
| Chemical name | <i>catena</i>-Poly[bis(piperazine-1,4-diium) [[tetraiodidoplumbate(II)]-μ-iodido] iodide monohydrate] |
|---|---|
| Formula | C8 H26 I6 N4 O Pb |
| Calculated formula | C8 H26 I6 N4 O Pb |
| SMILES | C1C[NH2+]CC[NH2+]1.I[Pb](I)(I)([I-])I.[I-].O.C1C[NH2+]CC[NH2+]1 |
| Title of publication | Crystal structure of a new hybrid compound based on an iodidoplumbate(II) anionic motif |
| Authors of publication | Mokhnache, Oualid; Boughzala, Habib |
| Journal of publication | Acta Crystallographica Section E |
| Year of publication | 2016 |
| Journal volume | 72 |
| Journal issue | 1 |
| Pages of publication | 56 - 59 |
| a | 8.7477 ± 0.001 Å |
| b | 13.488 ± 0.002 Å |
| c | 20.336 ± 0.003 Å |
| α | 90° |
| β | 90° |
| γ | 90° |
| Cell volume | 2399.4 ± 0.6 Å3 |
| Cell temperature | 298 ± 2 K |
| Ambient diffraction temperature | 298 ± 2 K |
| Number of distinct elements | 6 |
| Space group number | 62 |
| Hermann-Mauguin space group symbol | P n m a |
| Hall space group symbol | -P 2ac 2n |
| Residual factor for all reflections | 0.0663 |
| Residual factor for significantly intense reflections | 0.0372 |
| Weighted residual factors for significantly intense reflections | 0.0775 |
| Weighted residual factors for all reflections included in the refinement | 0.0862 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.05 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | Yes |
| Revision | Date | Message | Files |
|---|---|---|---|
| 181915 (current) | 2016-04-06 | hkl/2/24/ (antanas@echidna) Adding IUCr specific svn headers to multiple entries in subrange 2/24/14. |
2241427.cif 2241427.hkl |
| 176637 | 2016-02-17 | cif/ Updating files of 2241427 Original log message: Adding full bibliography for 2241427.cif. |
2241427.cif 2241427.hkl |
| 176584 | 2016-02-17 | cif/ Updating files of 2241427 Original log message: Adding full bibliography for 2241427.cif. |
2241427.cif 2241427.hkl |
| 171640 | 2015-12-20 | cif/ hkl/ Adding structures of 2241427 via cif-deposit CGI script. |
2241427.cif 2241427.hkl |
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Users of the data should acknowledge the original authors of the
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