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Information card for entry 7247946
Preview
| Coordinates | 7247946.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C20 H52.78 Cr2 Cu4 Mo12 N12 O61.39 |
|---|---|
| Calculated formula | C20 H50.8 Cr2 Cu4 Mo12 N12 O61.4 |
| Title of publication | Anderson-type polyoxometalate-based metal–organic framework as an efficient heterogeneous catalyst for selective oxidation of benzylic C–H bonds |
| Authors of publication | Tan, Hong-Ru; Zhou, Xiang; Gong, Tengfei; You, Hanqi; Zheng, Qi; Zhao, Sheng-Yin; Xuan, Weimin |
| Journal of publication | RSC Advances |
| Year of publication | 2024 |
| Journal volume | 14 |
| Journal issue | 1 |
| Pages of publication | 364 - 372 |
| a | 10.2257 ± 0.0009 Å |
| b | 14.332 ± 0.0016 Å |
| c | 14.3731 ± 0.0014 Å |
| α | 106.76 ± 0.004° |
| β | 110.599 ± 0.004° |
| γ | 105.352 ± 0.004° |
| Cell volume | 1723.2 ± 0.3 Å3 |
| Cell temperature | 150 K |
| Ambient diffraction temperature | 150 K |
| Number of distinct elements | 7 |
| Space group number | 1 |
| Hermann-Mauguin space group symbol | P 1 |
| Hall space group symbol | P 1 |
| Residual factor for all reflections | 0.0587 |
| Residual factor for significantly intense reflections | 0.0506 |
| Weighted residual factors for significantly intense reflections | 0.1169 |
| Weighted residual factors for all reflections included in the refinement | 0.1251 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.026 |
| Diffraction radiation probe | x-ray |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 288630 (current) | 2024-01-03 | cif/ Adding structures of 7247946 via cif-deposit CGI script. |
7247946.cif |
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Users of the data should acknowledge the original authors of the
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