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Information card for entry 1552356
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| Coordinates | 1552356.cif |
|---|---|
| Structure factors | 1552356.hkl |
| Original IUCr paper | HTML |
| Chemical name | (<i>E</i>)-1-(2-Hydroxy-6-methoxyphenyl)-3-(2-methoxynaphthalen-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-6-methoxyphenyl)-3-(2-methoxynaphthalen-1-yl)prop-2-en-1-one |
| Authors of publication | Sung, Jiha |
| Journal of publication | IUCrData |
| Year of publication | 2019 |
| Journal volume | 4 |
| Journal issue | 9 |
| Pages of publication | x191281 |
| a | 14.822 ± 0.0009 Å |
| b | 5.2416 ± 0.0003 Å |
| c | 20.8364 ± 0.0013 Å |
| α | 90° |
| β | 90° |
| γ | 90° |
| Cell volume | 1618.8 ± 0.17 Å3 |
| Cell temperature | 200 ± 2 K |
| Ambient diffraction temperature | 200 ± 2 K |
| Number of distinct elements | 3 |
| Space group number | 33 |
| Hermann-Mauguin space group symbol | P n a 21 |
| Hall space group symbol | P 2c -2n |
| Residual factor for all reflections | 0.0634 |
| Residual factor for significantly intense reflections | 0.0366 |
| Weighted residual factors for significantly intense reflections | 0.0696 |
| Weighted residual factors for all reflections included in the refinement | 0.0883 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.035 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | Yes |
| Revision | Date | Message | Files |
|---|---|---|---|
| 218919 (current) | 2019-09-28 | cif/ hkl/ Adding structures of 1552356 via cif-deposit CGI script. |
1552356.cif 1552356.hkl |
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