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Information card for entry 7712387
Preview
| Coordinates | 7712387.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C32 H96 Cl La N4 O44 S12 V12 |
|---|---|
| Calculated formula | C32 H96 Cl La N4 O44 S12 V12 |
| Title of publication | Mechanistic insights into template-driven polyoxovanadate self-assembly: the role of internal and external templates |
| Authors of publication | Repp, Stefan; Junginger, Kim; Sorsche, Dieter; Zorn, Theresa; Poppler, Ann-Christin; Kikukawa, Yuji; Hayashi, Yoshihito; Streb, Carsten |
| Journal of publication | Dalton Transactions |
| Year of publication | 2023 |
| a | 19.7197 ± 0.001 Å |
| b | 19.7197 ± 0.001 Å |
| c | 10.9727 ± 0.0006 Å |
| α | 90° |
| β | 90° |
| γ | 90° |
| Cell volume | 4266.9 ± 0.4 Å3 |
| Cell temperature | 150 K |
| Ambient diffraction temperature | 150 K |
| Number of distinct elements | 8 |
| Space group number | 85 |
| Hermann-Mauguin space group symbol | P 4/n :2 |
| Hall space group symbol | -P 4a |
| Residual factor for all reflections | 0.0353 |
| Residual factor for significantly intense reflections | 0.0308 |
| Weighted residual factors for significantly intense reflections | 0.0694 |
| Weighted residual factors for all reflections included in the refinement | 0.0723 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.078 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 281120 (current) | 2023-02-24 | cif/ Adding structures of 7712387, 7712388, 7712389 via cif-deposit CGI script. |
7712387.cif |
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