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Information card for entry 4349830
Preview
| Coordinates | 4349830.cif |
|---|---|
| Original paper (by DOI) | HTML |
| External links | PubChem |
| Formula | C18 H22 Mo12 N3 O42 P |
|---|---|
| Calculated formula | C18 H22 Mo12 N3 O42 P |
| Title of publication | Three-dimensional supramolecular phosphomolybdate architecture-derived Mo-based electrocatalytic system for overall water splitting |
| Authors of publication | Mei, Mingliang; Xu, Xinxin; Wang, Yun; Wang, Xinjiao; Huo, Yuqiu |
| Journal of publication | Inorganic Chemistry Frontiers |
| Year of publication | 2018 |
| Journal volume | 5 |
| Journal issue | 4 |
| Pages of publication | 819 |
| a | 14.6341 ± 0.0002 Å |
| b | 20.1216 ± 0.0004 Å |
| c | 15.7028 ± 0.0003 Å |
| α | 90° |
| β | 91.479 ± 0.002° |
| γ | 90° |
| Cell volume | 4622.33 ± 0.14 Å3 |
| Cell temperature | 293 ± 2 K |
| Ambient diffraction temperature | 293 ± 2 K |
| Number of distinct elements | 6 |
| Space group number | 14 |
| Hermann-Mauguin space group symbol | P 1 21/n 1 |
| Hall space group symbol | -P 2yn |
| Residual factor for all reflections | 0.0349 |
| Residual factor for significantly intense reflections | 0.0283 |
| Weighted residual factors for significantly intense reflections | 0.0771 |
| Weighted residual factors for all reflections included in the refinement | 0.0826 |
| Goodness-of-fit parameter for all reflections included in the refinement | 0.9 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 301840 (current) | 2025-08-21 | Add cross-references to PubChem compounds in COD range 4/34/ Each referenced PubChem compound corresponds to the full crystal structure. |
4349830.cif |
| 235871 | 2019-11-24 | cif/ Adding structures of 4349830 via cif-deposit CGI script. |
4349830.cif |
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Users of the data should acknowledge the original authors of the
structural data.