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Information card for entry 7123344
Preview
| Coordinates | 7123344.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C128 H172 N4 O24 Si4 |
|---|---|
| Calculated formula | C126.506 H166.024 N4 O22.506 Si4 |
| Title of publication | Silane catecholates: Versatile tools for self-assembled dynamic covalent bond chemistry |
| Authors of publication | Kabe, Yoshio; Kawakami, Yoshiteru; Ogishima, Tsuyoshi; Kawara, Tomoki; Yamauchi, Shota; Okamoto, Kazuhiko; Nikaido, Singo; Souma, Daiki; Jin, Ren-hua |
| Journal of publication | Chemical Communications |
| Year of publication | 2019 |
| a | 43.04 ± 0.05 Å |
| b | 9.038 ± 0.009 Å |
| c | 20.98 ± 0.02 Å |
| α | 90° |
| β | 114.772 ± 0.014° |
| γ | 90° |
| Cell volume | 7410 ± 13 Å3 |
| Cell temperature | 120 ± 2 K |
| Ambient diffraction temperature | 120 ± 2 K |
| Number of distinct elements | 5 |
| Space group number | 5 |
| Hermann-Mauguin space group symbol | C 1 2 1 |
| Hall space group symbol | C 2y |
| Residual factor for all reflections | 0.2062 |
| Residual factor for significantly intense reflections | 0.1748 |
| Weighted residual factors for significantly intense reflections | 0.4365 |
| Weighted residual factors for all reflections included in the refinement | 0.4671 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.345 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 214830 (current) | 2019-04-30 | cif/ Adding structures of 7123344, 7123345, 7123346 via cif-deposit CGI script. |
7123344.cif |
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Users of the data should acknowledge the original authors of the
structural data.