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Information card for entry 4004034
Preview
| Coordinates | 4004034.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Common name | DPT-eve |
|---|---|
| Formula | C14 H10 N4 |
| Calculated formula | C14 H10 N4 |
| Title of publication | Turning Flexibility into Rigidity: Stepwise Locking of Interpenetrating Networks in a MOF Crystal through Click Reaction |
| Authors of publication | Jędrzejowski, Damian; Pander, Marzena; Nitek, Wojciech; Bury, Wojciech; Matoga, Dariusz |
| Journal of publication | Chemistry of Materials |
| Year of publication | 2021 |
| Journal volume | 33 |
| Journal issue | 18 |
| Pages of publication | 7509 - 7517 |
| a | 26.8453 ± 0.0016 Å |
| b | 5.7386 ± 0.0003 Å |
| c | 7.249 ± 0.0004 Å |
| α | 90° |
| β | 107.645 ± 0.006° |
| γ | 90° |
| Cell volume | 1064.2 ± 0.11 Å3 |
| Cell temperature | 100 ± 2 K |
| Ambient diffraction temperature | 100 ± 2 K |
| Number of distinct elements | 3 |
| 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 | 0.0388 |
| Residual factor for significantly intense reflections | 0.038 |
| Weighted residual factors for significantly intense reflections | 0.1011 |
| Weighted residual factors for all reflections included in the refinement | 0.1027 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.067 |
| Diffraction radiation probe | x-ray |
| Diffraction radiation wavelength | 1.54184 Å |
| Diffraction radiation type | CuKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 269512 (current) | 2021-10-04 | cif/ Adding structures of 4004034 via cif-deposit CGI script. |
4004034.cif |
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Users of the data should acknowledge the original authors of the
structural data.