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Information card for entry 1557746
Preview
| Coordinates | 1557746.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C9 H9 K N O4 |
|---|---|
| Calculated formula | C9 H9 K N O4 |
| Title of publication | Unprecedented Water Effect as a Key Element in Salicyl-Glycine Schiff Base Synthesis. |
| Authors of publication | Bakalorz, Karolina; Przypis, Łukasz; Tomczyk, Mateusz Michał; Książek, Maria; Grzesik, Ryszard; Kuźnik, Nikodem |
| Journal of publication | Molecules (Basel, Switzerland) |
| Year of publication | 2020 |
| Journal volume | 25 |
| Journal issue | 5 |
| Pages of publication | 1257 |
| a | 18.879 ± 0.003 Å |
| b | 6.2395 ± 0.0006 Å |
| c | 8.7555 ± 0.0009 Å |
| α | 90° |
| β | 99.765 ± 0.012° |
| γ | 90° |
| Cell volume | 1016.4 ± 0.2 Å3 |
| Cell temperature | 120 ± 1 K |
| Ambient diffraction temperature | 120 ± 1 K |
| Number of distinct elements | 5 |
| Space group number | 14 |
| Hermann-Mauguin space group symbol | P 1 21/c 1 |
| Hall space group symbol | -P 2ybc |
| Residual factor for all reflections | 0.0869 |
| Residual factor for significantly intense reflections | 0.0615 |
| Weighted residual factors for significantly intense reflections | 0.1611 |
| Weighted residual factors for all reflections included in the refinement | 0.1854 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.077 |
| Diffraction radiation wavelength | 1.54184 Å |
| Diffraction radiation type | CuKα |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 250388 (current) | 2020-04-05 | cif/ Adding structures of 1557745, 1557746 via cif-deposit CGI script. |
1557746.cif |
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Users of the data should acknowledge the original authors of the
structural data.