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Information card for entry 4519421
Preview
| Coordinates | 4519421.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Chemical name | (2E,6E)-2,6-bis[4-(dimethylamino)benzylidene]cyclohexanone |
|---|---|
| Formula | C24 H28 N2 O |
| Calculated formula | C24 H28 N2 O |
| Title of publication | Structure–Property Relationships of Dibenzylidenecyclohexanones |
| Authors of publication | Fomina, Marina V.; Vatsadze, Sergey Z.; Freidzon, Alexandra Ya.; Kuz’mina, Lyudmila G.; Moiseeva, Anna A.; Starostin, Roman O.; Nuriev, Vyacheslav N.; Gromov, Sergey P. |
| Journal of publication | ACS Omega |
| Year of publication | 2022 |
| Journal volume | 7 |
| Journal issue | 12 |
| Pages of publication | 10087 - 10099 |
| a | 21.798 ± 0.003 Å |
| b | 8.9774 ± 0.0016 Å |
| c | 9.6932 ± 0.0018 Å |
| α | 90° |
| β | 90° |
| γ | 90° |
| Cell volume | 1896.9 ± 0.6 Å3 |
| Cell temperature | 150 ± 2 K |
| Ambient diffraction temperature | 150 ± 2 K |
| Number of distinct elements | 4 |
| Space group number | 36 |
| Hermann-Mauguin space group symbol | C m c 21 |
| Hall space group symbol | C 2c -2 |
| Residual factor for all reflections | 0.0713 |
| Residual factor for significantly intense reflections | 0.0457 |
| Weighted residual factors for significantly intense reflections | 0.0995 |
| Weighted residual factors for all reflections included in the refinement | 0.1087 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.032 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
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