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Information card for entry 1552164
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| Coordinates | 1552164.cif |
|---|---|
| Structure factors | 1552164.hkl |
| Original paper (by DOI) | HTML |
| Chemical name | Bis(μ~2~-4-nitrophenolato)bis(4-nitrophenolato)di-μ~3~-oxido-octaphenyltetratin chloroform sesquisolvate [+ solvate] |
|---|---|
| Formula | C73.5 H57.5 Cl4.5 N4 O14 Sn4 |
| Calculated formula | C73.5 H57.5 Cl4.5 N4 O14 Sn4 |
| SMILES | [Sn]1([O]2[Sn]([O]3[Sn](Oc4ccc(N(=O)=O)cc4)([O]([Sn]23(c2ccccc2)c2ccccc2)c2ccc(N(=O)=O)cc2)(c2ccccc2)c2ccccc2)([O]1c1ccc(N(=O)=O)cc1)(c1ccccc1)c1ccccc1)(Oc1ccc(N(=O)=O)cc1)(c1ccccc1)c1ccccc1.ClC(Cl)Cl.ClC(Cl)Cl |
| Title of publication | Bis(μ2-4-nitrophenolato)bis(4-nitrophenolato)di-μ3-oxido-octaphenyltetratin chloroform sesquisolvate [+ solvate]: a tetranuclear stannoxane |
| Authors of publication | Butler, Patrick |
| Journal of publication | IUCrData |
| Year of publication | 2019 |
| Journal volume | 4 |
| Journal issue | 8 |
| Pages of publication | x191067 |
| a | 12.8262 ± 0.0002 Å |
| b | 22.1075 ± 0.0004 Å |
| c | 28.9552 ± 0.0005 Å |
| α | 72.349 ± 0.002° |
| β | 79.8 ± 0.002° |
| γ | 89.827 ± 0.001° |
| Cell volume | 7689 ± 0.2 Å3 |
| Cell temperature | 150 ± 1 K |
| Ambient diffraction temperature | 150 ± 0.1 K |
| Number of distinct elements | 6 |
| Space group number | 2 |
| Hermann-Mauguin space group symbol | P -1 |
| Hall space group symbol | -P 1 |
| Residual factor for all reflections | 0.0942 |
| Residual factor for significantly intense reflections | 0.0691 |
| Weighted residual factors for significantly intense reflections | 0.1746 |
| Weighted residual factors for all reflections included in the refinement | 0.1967 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.042 |
| Diffraction radiation probe | x-ray |
| Diffraction radiation wavelength | 1.54184 Å |
| Diffraction radiation type | CuKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | Yes |
| Revision | Date | Message | Files |
|---|---|---|---|
| 300370 (current) | 2025-07-05 | Updating bibliography information from the data sent by Robert McMeeking. cod/ (saulius@pterodaktilis) |
1552164.cif 1552164.hkl |
| 217454 | 2019-08-07 | cif/ hkl/ Adding structures of 1552164 via cif-deposit CGI script. |
1552164.cif 1552164.hkl |
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