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Information card for entry 2244016
Preview
| Coordinates | 2244016.cif |
|---|---|
| Structure factors | 2244016.hkl |
| Original IUCr paper | HTML |
| Common name | Sodium-serinol paratungstate B |
|---|---|
| Chemical name | Hexasodium tetraserinolium di-μ~3~-hydroxido-tetra-μ~3~-oxido-octadeca-μ-oxido-octadecaoxidododecatungstate decahydrate |
| Formula | C12 H62 N4 Na6 O60 W12 |
| Calculated formula | C12 H56 N4 Na6 O60 W12 |
| Title of publication | Crystal structure of hexasodium tetraserinolium paratungstate B decahydrate, [Na~6~{(CH~2~OH)~2~CHNH~3~}~4~][W~12~O~40~(OH)~2~]·10H~2~O |
| Authors of publication | Sifaki, Kleanthi; Gumerova, Nadiia I.; Giester, Gerald; Rompel, Annette |
| Journal of publication | Acta Crystallographica Section E |
| Year of publication | 2022 |
| Journal volume | 78 |
| Journal issue | 2 |
| a | 12.0541 ± 0.0008 Å |
| b | 12.0821 ± 0.0008 Å |
| c | 12.705 ± 0.0008 Å |
| α | 73.18 ± 0.002° |
| β | 65.308 ± 0.002° |
| γ | 64.345 ± 0.002° |
| Cell volume | 1502.07 ± 0.17 Å3 |
| Cell temperature | 200.15 K |
| Ambient diffraction temperature | 200.15 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 | 0.0176 |
| Residual factor for significantly intense reflections | 0.0171 |
| Weighted residual factors for significantly intense reflections | 0.0422 |
| Weighted residual factors for all reflections included in the refinement | 0.0425 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.247 |
| Diffraction radiation probe | x-ray |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | Yes |
| Revision | Date | Message | Files |
|---|---|---|---|
| 272125 (current) | 2022-01-19 | cif/ hkl/ Adding structures of 2244016 via cif-deposit CGI script. |
2244016.cif 2244016.hkl |
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Users of the data should acknowledge the original authors of the
structural data.