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Information card for entry 1549998
Preview
| Coordinates | 1549998.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C16 H104 Mn Mo12 N16 O74 P8 |
|---|---|
| Calculated formula | C16 H104 Mn Mo12 N16 O74 P8 |
| Title of publication | Hetero-metallic Active Sites Coupled with Strong Reductive Polyoxometalate for Selectively Photocatalytic CO2-to-CH4 Conversion in Water |
| Authors of publication | Su, Zhong-Min; Xie, Shuai-Lei; Liu, Jiang; Dong, Long-Zhang; Li, Shun-Li; Lan, Ya-Qian |
| Journal of publication | Chemical Science |
| Year of publication | 2018 |
| a | 15.8641 ± 0.0014 Å |
| b | 15.937 ± 0.0016 Å |
| c | 17.1695 ± 0.0017 Å |
| α | 90° |
| β | 92.645 ± 0.002° |
| γ | 90° |
| Cell volume | 4336.3 ± 0.7 Å3 |
| Cell temperature | 296 ± 2 K |
| Ambient diffraction temperature | 296.15 K |
| Number of distinct elements | 7 |
| 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 | 0.0625 |
| Residual factor for significantly intense reflections | 0.0418 |
| Weighted residual factors for significantly intense reflections | 0.0985 |
| Weighted residual factors for all reflections included in the refinement | 0.1144 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.186 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 211284 (current) | 2018-10-03 | cif/ Adding structures of 1549998, 1549999, 1550000 via cif-deposit CGI script. |
1549998.cif |
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