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Information card for entry 7701994
Preview
| Coordinates | 7701994.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C60 H143 Cu6 K3 N12 Nb16 O95 |
|---|---|
| Calculated formula | C60 H48 Cu6 K3 N12 Nb16 O69 |
| Title of publication | Two synthetic routes generate two isopolyoxoniobates based on {Nb16} and {Nb20} |
| Authors of publication | Niu, Jingyang; Liang, Zhijie; Qiao, Yuanyuan; Li, Miaomiao; Ma, Pengtao; Wang, Jingping |
| Journal of publication | Dalton Transactions |
| Year of publication | 2019 |
| a | 24.7006 ± 0.0016 Å |
| b | 24.1052 ± 0.0017 Å |
| c | 24.8467 ± 0.0016 Å |
| α | 90° |
| β | 118.302 ± 0.0011° |
| γ | 90° |
| Cell volume | 13025.6 ± 1.5 Å3 |
| Cell temperature | 296 ± 2 K |
| Ambient diffraction temperature | 296.15 K |
| Number of distinct elements | 7 |
| 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 | 0.09 |
| Residual factor for significantly intense reflections | 0.0542 |
| Weighted residual factors for significantly intense reflections | 0.1487 |
| Weighted residual factors for all reflections included in the refinement | 0.1755 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.038 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 231110 (current) | 2019-11-21 | cif/ Adding structures of 7701994, 7701995 via cif-deposit CGI script. |
7701994.cif |
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