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Information card for entry 4038050
Preview
| Coordinates | 4038050.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C18 H26 Na2 O10 |
|---|---|
| Calculated formula | C18 H26 Na2 O10 |
| Title of publication | Synthesis of Diaryl Hydroxyl Dicarboxylic Acids from Amino Acids. |
| Authors of publication | Eronen, Aleksi E. K.; Mannisto, Jere K.; Moslova, Karina; Nieger, Martin; Heliövaara, Eeva; Repo, Timo |
| Journal of publication | The Journal of organic chemistry |
| Year of publication | 2020 |
| a | 6.2002 ± 0.0002 Å |
| b | 8.7727 ± 0.0003 Å |
| c | 19.3378 ± 0.0007 Å |
| α | 101.692 ± 0.001° |
| β | 93.848 ± 0.001° |
| γ | 90.292 ± 0.001° |
| Cell volume | 1027.5 ± 0.06 Å3 |
| Cell temperature | 123 ± 2 K |
| Ambient diffraction temperature | 123 ± 2 K |
| Number of distinct elements | 4 |
| Space group number | 2 |
| Hermann-Mauguin space group symbol | P -1 |
| Hall space group symbol | -P 1 |
| Residual factor for all reflections | 0.0297 |
| Residual factor for significantly intense reflections | 0.0288 |
| Weighted residual factors for significantly intense reflections | 0.0747 |
| Weighted residual factors for all reflections included in the refinement | 0.0753 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.058 |
| Diffraction radiation wavelength | 1.54178 Å |
| Diffraction radiation type | CuKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 249241 (current) | 2020-03-11 | cif/ Adding structures of 4038050, 4038051 via cif-deposit CGI script. |
4038050.cif |
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Users of the data should acknowledge the original authors of the
structural data.