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Information card for entry 7122876
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| Coordinates | 7122876.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Chemical name | [MoIV(CN)8]6[Ni(L)]12(H2O)6 |
|---|---|
| Formula | C38 H46 Mo N16 Ni2 O |
| Calculated formula | C38 H46 Mo N16 Ni2 O |
| Title of publication | A cyanide-bridged wheel featuring a seven-coordinate Mo(III) center |
| Authors of publication | Kempe, David Kenneth; Dolinar, Brian; Vignesh, Kuduva R.; Woods, Toby; Saber, Mohamed R.; Dunbar, Kim R. |
| Journal of publication | Chemical Communications |
| Year of publication | 2019 |
| a | 33.6548 ± 0.0008 Å |
| b | 33.6548 ± 0.0008 Å |
| c | 24.819 ± 0.0006 Å |
| α | 90° |
| β | 90° |
| γ | 120° |
| Cell volume | 24345 ± 1 Å3 |
| Cell temperature | 100 K |
| Ambient diffraction temperature | 100 K |
| Number of distinct elements | 6 |
| Space group number | 148 |
| Hermann-Mauguin space group symbol | R -3 |
| Hall space group symbol | -R 3 |
| Residual factor for all reflections | 0.0418 |
| Residual factor for significantly intense reflections | 0.0346 |
| Weighted residual factors for significantly intense reflections | 0.0863 |
| Weighted residual factors for all reflections included in the refinement | 0.0894 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.051 |
| Diffraction radiation probe | x-ray |
| Diffraction radiation wavelength | 1.54178 Å |
| Diffraction radiation type | CuKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 213212 (current) | 2019-01-19 | cif/ Adding structures of 7122875, 7122876 via cif-deposit CGI script. |
7122876.cif |
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