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Information card for entry 8103104
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| Coordinates | 8103104.cif |
|---|---|
| External links | PubChem |
| Chemical name | N6O18Sr.2(C10H10N2).2(C3H5N2).2(C3H4N2).2(C3H3N2).(H2O) |
|---|---|
| Formula | C38 H46 N22 O19 Sr |
| Calculated formula | C38 H46 N22 O19 Sr |
| Title of publication | Crystal structure of bis(4,4'-bipyridinium) bis(imidazolium) hexanitratostrontium(II) bis(imidazolate) — imidazole — water (1:2:1), [C10H10N2]2[C3H5N2]2[Sr(NO3)6][C3H3N2]2 · 2C3H4N2 · H2O |
| Authors of publication | Wenyan Bi; Li Guanghua; Qing Xue; Yu Huo; Gaopeng Wang |
| Journal of publication | Zeitschrift für Kristallographie - New Crystal Structures |
| Year of publication | 2011 |
| Journal volume | 226 |
| Journal issue | 1 |
| Pages of publication | 121 |
| a | 8.957 ± 0.0014 Å |
| b | 13.055 ± 0.002 Å |
| c | 23.67 ± 0.003 Å |
| α | 90° |
| β | 110.267 ± 0.005° |
| γ | 90° |
| Cell volume | 2596.5 ± 0.7 Å3 |
| Cell temperature | 296 ± 2 K |
| Ambient diffraction temperature | 296 ± 2 K |
| Number of distinct elements | 5 |
| Space group number | 13 |
| Hermann-Mauguin space group symbol | P 1 2/c 1 |
| Hall space group symbol | -P 2yc |
| Residual factor for all reflections | 0.0705 |
| Residual factor for significantly intense reflections | 0.0437 |
| Weighted residual factors for significantly intense reflections | 0.1013 |
| Weighted residual factors for all reflections included in the refinement | 0.1133 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.005 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 301880 (current) | 2025-08-23 | Add cross-references to PubChem compounds in COD range 8/ Each referenced PubChem compound corresponds to the full crystal structure. |
8103104.cif |
| 176728 | 2016-02-18 | cif/ (antanas@echidna.ibt.lt) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in range 8. |
8103104.cif |
| 35911 | 2012-02-28 | cif/ Reorganising ranges 1, 3, 5, 6 and 8 into a prefix-directory tree. |
8103104.cif |
| 29037 | 2011-11-02 | ../uploads/cif-deposit/cod/cif Adding structures of 8103104 via cif-deposit CGI script. |
8103104.cif |
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Users of the data should acknowledge the original authors of the
structural data.