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Information card for entry 2237683
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| Coordinates | 2237683.cif |
|---|---|
| Structure factors | 2237683.hkl |
| Original IUCr paper | HTML |
| Chemical name | Bis(3-azaniumylpyridin-1-ium) hexachloridostannate(IV) dichloride |
|---|---|
| Formula | C10 H16 Cl8 N4 Sn |
| Calculated formula | C10 H16 Cl8 N4 Sn |
| SMILES | c1(ccc[nH+]c1)[NH3+].[Cl-].[Cl-][Sn](Cl)(Cl)(Cl)(Cl)[Cl-].c1(ccc[nH+]c1)[NH3+].[Cl-] |
| Title of publication | Bis(3-azaniumylpyridin-1-ium) hexachloridostannate(IV) dichloride |
| Authors of publication | van Megen, Martin; Prömper, Stephan; Reiss, Guido J. |
| Journal of publication | Acta Crystallographica Section E |
| Year of publication | 2013 |
| Journal volume | 69 |
| Journal issue | 4 |
| Pages of publication | m217 |
| a | 11.9379 ± 0.0003 Å |
| b | 10.3704 ± 0.0003 Å |
| c | 16.7018 ± 0.0005 Å |
| α | 90° |
| β | 90° |
| γ | 90° |
| Cell volume | 2067.7 ± 0.1 Å3 |
| Cell temperature | 290 ± 2 K |
| Ambient diffraction temperature | 290 ± 2 K |
| Number of distinct elements | 5 |
| Space group number | 61 |
| Hermann-Mauguin space group symbol | P b c a |
| Hall space group symbol | -P 2ac 2ab |
| Residual factor for all reflections | 0.031 |
| Residual factor for significantly intense reflections | 0.0204 |
| Weighted residual factors for significantly intense reflections | 0.0414 |
| Weighted residual factors for all reflections included in the refinement | 0.0439 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.056 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | Yes |
| Revision | Date | Message | Files |
|---|---|---|---|
| 181298 (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 2/23/76. |
2237683.cif 2237683.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. |
2237683.cif 2237683.hkl |
| 88055 | 2013-08-28 | cod/cif/ (saulius@koala.ibt.lt) Adding the _cod_database_fobs_code links for those COD CIFs that have their Fobs deposited recently. |
2237683.cif 2237683.hkl |
| 88054 | 2013-08-28 | cod/hkl/ (saulius@koala.ibt.lt) Adding Fobs files for the recently deposited IUCr coordinate data. |
2237683.cif 2237683.hkl |
| 85433 | 2013-05-07 | cif/ Adding structures of 2237683 via cif-deposit CGI script. |
2237683.cif |
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Users of the data should acknowledge the original authors of the
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