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Information card for entry 1572293
Preview
| Coordinates | 1572293.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C17 H26 O |
|---|---|
| Calculated formula | C17 H26 O |
| SMILES | O=C(c1c(cc(cc1C(C)C)C(C)C)C(C)C)C |
| Title of publication | Study of the Influence of the Change from Methyl to Isopropyl Substituents in 1-(2,4,6-trialkylphenyl)ethanol on the Point Group Symmetry of the 0-D Hydrogen-Bonded Moiety |
| Authors of publication | Iwanek (nee Wilczkowska), Ewa M.; Gliński, Marek |
| Journal of publication | Crystals |
| Year of publication | 2024 |
| Journal volume | 14 |
| Journal issue | 7 |
| Pages of publication | 642 |
| a | 5.921 ± 0.001 Å |
| b | 20.42 ± 0.004 Å |
| c | 13.5 ± 0.003 Å |
| α | 90° |
| β | 93.11 ± 0.03° |
| γ | 90° |
| Cell volume | 1629.8 ± 0.6 Å3 |
| Number of distinct elements | 3 |
| Space group number | 14 |
| Hermann-Mauguin space group symbol | P 1 21/n 1 |
| Hall space group symbol | -P 2yn |
| Residual factor for all reflections | 0.117 |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 293966 (current) | 2024-08-06 | cif/ Adding structures of 1572293 via cif-deposit CGI script. |
1572293.cif |
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