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Information card for entry 7244987
Preview
| Coordinates | 7244987.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C22.5 H22.5 Fe N7.5 O3.5 |
|---|---|
| Calculated formula | C22.5 H22.5 Fe N7.5 O3.5 |
| Title of publication | Metal ions impact on the isostructurality and properties of 2D coordination polymers |
| Authors of publication | Chumakov, Yuri; Danilescu, Olga; Bourosh, P.; Kulikova, Olga V.; Bulhac, Ion; Croitor, Lilia |
| Journal of publication | CrystEngComm |
| Year of publication | 2022 |
| a | 12.377 ± 0.003 Å |
| b | 9.4953 ± 0.0013 Å |
| c | 10.2036 ± 0.0015 Å |
| α | 90° |
| β | 90° |
| γ | 90° |
| Cell volume | 1199.2 ± 0.4 Å3 |
| Cell temperature | 293 ± 2 K |
| Ambient diffraction temperature | 293 ± 2 K |
| Number of distinct elements | 5 |
| Space group number | 18 |
| Hermann-Mauguin space group symbol | P 21 21 2 |
| Hall space group symbol | P 2 2ab |
| Residual factor for all reflections | 0.1393 |
| Residual factor for significantly intense reflections | 0.0775 |
| Weighted residual factors for significantly intense reflections | 0.1142 |
| Weighted residual factors for all reflections included in the refinement | 0.1381 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 275659 (current) | 2022-05-27 | cif/ Adding structures of 7244987, 7244988 via cif-deposit CGI script. |
7244987.cif |
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Users of the data should acknowledge the original authors of the
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