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Information card for entry 4515120
Preview
| Coordinates | 4515120.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C6.25 H6 O12.5 Zn3 |
|---|---|
| Calculated formula | C6.25 H6 O12.5 Zn3 |
| Title of publication | Exploring Host-Guest Interactions in the α-Zn<sub>3</sub>(HCOO)<sub>6</sub> Metal-Organic Framework. |
| Authors of publication | Wu, Bowei; Wong, Y. T. Angel; Lucier, Bryan E. G.; Boyle, Paul D.; Huang, Yining |
| Journal of publication | ACS omega |
| Year of publication | 2019 |
| Journal volume | 4 |
| Journal issue | 2 |
| Pages of publication | 4000 - 4011 |
| a | 11.3261 ± 0.0015 Å |
| b | 9.821 ± 0.0014 Å |
| c | 14.4412 ± 0.0019 Å |
| α | 90° |
| β | 91.297 ± 0.005° |
| γ | 90° |
| Cell volume | 1605.9 ± 0.4 Å3 |
| Cell temperature | 120 K |
| Ambient diffraction temperature | 120 K |
| Number of distinct elements | 4 |
| 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 | 0.0306 |
| Residual factor for significantly intense reflections | 0.0303 |
| Weighted residual factors for significantly intense reflections | 0.0986 |
| Weighted residual factors for all reflections included in the refinement | 0.0992 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.224 |
| Diffraction radiation wavelength | 1.54178 Å |
| Diffraction radiation type | CuKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 220234 (current) | 2019-10-28 | cif/ Adding structures of 4515120 via cif-deposit CGI script. |
4515120.cif |
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