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Information card for entry 1571498
Preview
| Coordinates | 1571498.cif |
|---|---|
| Original IUCr paper | HTML |
| Chemical name | (2<i>E</i>,2'<i>E</i>)-1,1'-([1,1'-Biphenyl]-4,4'-diyl)bis[3-(dimethylamino)prop-2-en-1-one] |
|---|---|
| Formula | C22 H24 N2 O2 |
| Calculated formula | C22 H24 N2 O2 |
| Title of publication | (2E,2′E)-1,1′-([1,1′-Biphenyl]-4,4′-diyl)bis[3-(dimethylamino)prop-2-en-1-one] |
| Authors of publication | Minagawa, Tomohiro; Sadakiyo, Masaaki |
| Journal of publication | IUCrData |
| Year of publication | 2024 |
| Journal volume | 9 |
| Journal issue | 4 |
| a | 15.862 ± 0.001 Å |
| b | 6.0503 ± 0.0004 Å |
| c | 19.064 ± 0.0012 Å |
| α | 90° |
| β | 105.287 ± 0.003° |
| γ | 90° |
| Cell volume | 1764.8 ± 0.2 Å3 |
| Cell temperature | 90 ± 2 K |
| Ambient diffraction temperature | 90 ± 2 K |
| Number of distinct elements | 4 |
| 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 | 0.0909 |
| Residual factor for significantly intense reflections | 0.0632 |
| Weighted residual factors for significantly intense reflections | 0.1308 |
| Weighted residual factors for all reflections included in the refinement | 0.154 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.076 |
| Diffraction radiation wavelength | 0.71069 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 291392 (current) | 2024-04-27 | cif/ Adding structures of 1571498 via cif-deposit CGI script. |
1571498.cif |
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