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Information card for entry 7714454
Preview
| Coordinates | 7714454.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C30 H58 N6 O30 S6 Sr Zn6 |
|---|---|
| Calculated formula | C30 H21 N6 O27 S6 Sr Zn6 |
| Title of publication | Selective cycloaddition of ethylene oxide to CO2 within the confined space of an amino acid-based metal-organic framework |
| Authors of publication | Bilanin Artigado, Cristina; Escamilla, Paula; Ferrando-Soria, Jesús; Leyva-Perez, Antonio; Armentano, Donatella; Pardo, Emilio |
| Journal of publication | Dalton Transactions |
| Year of publication | 2023 |
| a | 18.5594 ± 0.0015 Å |
| b | 18.5594 ± 0.0015 Å |
| c | 11.7771 ± 0.0013 Å |
| α | 90° |
| β | 90° |
| γ | 120° |
| Cell volume | 3513.2 ± 0.6 Å3 |
| Cell temperature | 100 ± 2 K |
| Ambient diffraction temperature | 100 ± 2 K |
| Number of distinct elements | 7 |
| Space group number | 173 |
| Hermann-Mauguin space group symbol | P 63 |
| Hall space group symbol | P 6c |
| Residual factor for all reflections | 0.1196 |
| Residual factor for significantly intense reflections | 0.0597 |
| Weighted residual factors for significantly intense reflections | 0.1571 |
| Weighted residual factors for all reflections included in the refinement | 0.1907 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.029 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 287570 (current) | 2023-11-14 | cif/ Adding structures of 7714454 via cif-deposit CGI script. |
7714454.cif |
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