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Information card for entry 7245241
Preview
| Coordinates | 7245241.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C58 H122 Nb6 O34 |
|---|---|
| Calculated formula | C58 H122 Nb6 O34 |
| Title of publication | Molecular niobium(V) complexes with mononuclear {Nb1} and dinuclear oxo species {Nb2O} connected through aryl di- or tetra-carboxylate linker |
| Authors of publication | Andriotou, Despoina; Duval, Sylvain; Trivelli, Xavier; Volkringer, Christophe; Loiseau, Thierry |
| Journal of publication | CrystEngComm |
| Year of publication | 2022 |
| a | 24.0297 ± 0.0014 Å |
| b | 18.1938 ± 0.0011 Å |
| c | 19.0238 ± 0.0011 Å |
| α | 90° |
| β | 97.312 ± 0.003° |
| γ | 90° |
| Cell volume | 8249.4 ± 0.8 Å3 |
| Cell temperature | 106.73 K |
| Ambient diffraction temperature | 106.73 K |
| Number of distinct elements | 4 |
| Space group number | 15 |
| Hermann-Mauguin space group symbol | C 1 2/c 1 |
| Hall space group symbol | -C 2yc |
| Residual factor for all reflections | 0.075 |
| Residual factor for significantly intense reflections | 0.058 |
| Weighted residual factors for significantly intense reflections | 0.1379 |
| Weighted residual factors for all reflections included in the refinement | 0.1521 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.05 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 277046 (current) | 2022-08-03 | cif/ Adding structures of 7245241, 7245242, 7245243 via cif-deposit CGI script. |
7245241.cif |
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