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Information card for entry 4349519
Preview
| Coordinates | 4349519.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C39 H25 Cu3 N6 O13 |
|---|---|
| Calculated formula | C39 H25 Cu3 N6 O13 |
| Title of publication | A microporous Cu2+MOF based on a pyridyl isophthalic acid Schiff base ligand with high CO2uptake |
| Authors of publication | Kourtellaris, Andreas; Moushi, Eleni E.; Spanopoulos, Ioannis; Tampaxis, Christos; Charalambopoulou, Georgia; Steriotis, Theodore A.; Papaefstathiou, Giannis S.; Trikalitis, Pantelis N.; Tasiopoulos, Anastasios J. |
| Journal of publication | Inorganic Chemistry Frontiers |
| Year of publication | 2016 |
| Journal volume | 3 |
| Journal issue | 12 |
| Pages of publication | 1527 |
| a | 13.657 ± 0.005 Å |
| b | 18.686 ± 0.005 Å |
| c | 31.503 ± 0.005 Å |
| α | 90 ± 0.005° |
| β | 101.532 ± 0.005° |
| γ | 90 ± 0.005° |
| Cell volume | 7877 ± 4 Å3 |
| Cell temperature | 100 ± 2 K |
| Ambient diffraction temperature | 100 ± 2 K |
| Number of distinct elements | 5 |
| Space group number | 12 |
| Hermann-Mauguin space group symbol | I 1 2/m 1 |
| Hall space group symbol | -I 2y |
| Residual factor for all reflections | 0.0898 |
| Residual factor for significantly intense reflections | 0.0765 |
| Weighted residual factors for significantly intense reflections | 0.2362 |
| Weighted residual factors for all reflections included in the refinement | 0.2505 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.189 |
| Diffraction radiation wavelength | 1.5418 Å |
| Diffraction radiation type | CuKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 234849 (current) | 2019-11-23 | cif/ Adding structures of 4349519 via cif-deposit CGI script. |
4349519.cif |
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