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Information card for entry 1550750
Preview
| Coordinates | 1550750.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C36 H40 N14 Ni3 O22 |
|---|---|
| Calculated formula | C36 H40 N14 Ni3 O22 |
| Title of publication | A two-dimensional Ni(II) coordination polymer based on 3,5-bis(1’,2’,4’-triazol-1’-yl) pyridine ligand for water electro-oxidation |
| Authors of publication | Wang, Chunling; Song, Chuanqqi; Shen, Wen-Hui; Qi, Yuan-Yuan; Xue, Ying; Shi, Yao-Cheng; Yu, Huaguang; Feng, Ligang |
| Journal of publication | Catalysis Science & Technology |
| Year of publication | 2019 |
| a | 20.1497 ± 0.0019 Å |
| b | 7.1876 ± 0.0007 Å |
| c | 34.937 ± 0.004 Å |
| α | 90° |
| β | 94.669 ± 0.003° |
| γ | 90° |
| Cell volume | 5043.1 ± 0.9 Å3 |
| Cell temperature | 295 ± 2 K |
| Ambient diffraction temperature | 295 K |
| Number of distinct elements | 5 |
| 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 | 0.0852 |
| Residual factor for significantly intense reflections | 0.0483 |
| Weighted residual factors for significantly intense reflections | 0.1178 |
| Weighted residual factors for all reflections included in the refinement | 0.1319 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.032 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 214131 (current) | 2019-03-16 | cif/ Adding structures of 1550749, 1550750 via cif-deposit CGI script. |
1550750.cif |
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