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Information card for entry 4346653
Preview
| Coordinates | 4346653.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Chemical name | CuCPB1 |
|---|---|
| Formula | C57 H47 Cu3 N3 O16 |
| Calculated formula | C57 H47 Cu3 N3 O16 |
| Title of publication | Synthesis and Selective CO2 Capture Properties of a Series of Hexatopic Linker-Based Metal-Organic Frameworks. |
| Authors of publication | Nguyen, Phuong T. K.; Nguyen, Huong T. D.; Pham, Hung Q.; Kim, Jaheon; Cordova, Kyle E.; Furukawa, Hiroyasu |
| Journal of publication | Inorganic chemistry |
| Year of publication | 2015 |
| Journal volume | 54 |
| Journal issue | 20 |
| Pages of publication | 10065 - 10072 |
| a | 11.54 ± 0.003 Å |
| b | 16.778 ± 0.004 Å |
| c | 28.468 ± 0.008 Å |
| α | 90° |
| β | 90° |
| γ | 90° |
| Cell volume | 5512 ± 2 Å3 |
| Cell temperature | 100 K |
| Ambient diffraction temperature | 100 K |
| Number of distinct elements | 5 |
| Space group number | 19 |
| Hermann-Mauguin space group symbol | P 21 21 21 |
| Hall space group symbol | P 2ac 2ab |
| Residual factor for all reflections | 0.1413 |
| Residual factor for significantly intense reflections | 0.1289 |
| Weighted residual factors for significantly intense reflections | 0.2992 |
| Weighted residual factors for all reflections included in the refinement | 0.309 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.07 |
| Diffraction radiation wavelength | 1.54178 Å |
| Diffraction radiation type | CuKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 231904 (current) | 2019-11-23 | cif/ Adding structures of 4346653 via cif-deposit CGI script. |
4346653.cif |
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Users of the data should acknowledge the original authors of the
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