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Information card for entry 7123979
Preview
| Coordinates | 7123979.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C156 H228 Cl4 N24 O176 S6 V40 W4 |
|---|---|
| Calculated formula | C136 H148 Cl4 N14 O176 S6 V40 W4 |
| Title of publication | Two polyoxovanadate-based metal-organic polyhedra with undiscovered “Near-miss Johnson Solid” geometry† |
| Authors of publication | Gong, Yaru; Tao, Yanli; Xu, Na; Sun, Chun-Yi; Wang, Xinlong; Su, Zhong-Min |
| Journal of publication | Chemical Communications |
| Year of publication | 2019 |
| a | 41.892 ± 0.005 Å |
| b | 21.947 ± 0.002 Å |
| c | 46.7 ± 0.005 Å |
| α | 90° |
| β | 103.267 ± 0.004° |
| γ | 90° |
| Cell volume | 41790 ± 8 Å3 |
| Cell temperature | 296 ± 2 K |
| Ambient diffraction temperature | 296.02 K |
| Number of distinct elements | 8 |
| 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 | 0.0883 |
| Residual factor for significantly intense reflections | 0.0612 |
| Weighted residual factors for significantly intense reflections | 0.164 |
| Weighted residual factors for all reflections included in the refinement | 0.1853 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.018 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 217497 (current) | 2019-08-13 | cif/ Adding structures of 7123978, 7123979 via cif-deposit CGI script. |
7123979.cif |
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Users of the data should acknowledge the original authors of the
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