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Information card for entry 1567694
Preview
| Coordinates | 1567694.cif |
|---|---|
| Original IUCr paper | HTML |
| Chemical name | (<i>E</i>)-1-(2-Hydroxy-4,6-dimethoxyphenyl)-3-(naphthalen-1-yl)prop-2-en-1-one |
|---|---|
| Formula | C21 H18 O4 |
| Calculated formula | C21 H18 O4 |
| Title of publication | (<i>E</i>)-1-(2-Hydroxy-4,6-dimethoxyphenyl)-3-(naphthalen-1-yl)prop-2-en-1-one |
| Authors of publication | Koh, Dongsoo |
| Journal of publication | IUCrData |
| Year of publication | 2022 |
| Journal volume | 7 |
| Journal issue | 9 |
| Pages of publication | x220932 |
| a | 15.8594 ± 0.0007 Å |
| b | 5.0437 ± 0.0002 Å |
| c | 40.6908 ± 0.0017 Å |
| α | 90° |
| β | 90.507 ± 0.002° |
| γ | 90° |
| Cell volume | 3254.7 ± 0.2 Å3 |
| Cell temperature | 147 ± 2 K |
| Ambient diffraction temperature | 147 ± 2 K |
| Number of distinct elements | 3 |
| Space group number | 15 |
| Hermann-Mauguin space group symbol | C 1 2/c 1 |
| Hall space group symbol | -C 2yc |
| Residual factor for all reflections | 0.0389 |
| Residual factor for significantly intense reflections | 0.037 |
| Weighted residual factors for significantly intense reflections | 0.0962 |
| Weighted residual factors for all reflections included in the refinement | 0.0978 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.034 |
| Diffraction radiation wavelength | 1.54178 Å |
| Diffraction radiation type | CuKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 278243 (current) | 2022-09-28 | cif/ Adding structures of 1567694 via cif-deposit CGI script. |
1567694.cif |
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