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Information card for entry 1572880
Preview
| Coordinates | 1572880.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Chemical name | 2-(4-bromobenzoyel)-3-(4-dimethylamio)phenyl)-2,3-dihydro-4H-furo[3,2-c]chromen-4-one |
|---|---|
| Formula | C26 H20 Br N O4 |
| Calculated formula | C26 H20 Br N O4 |
| a | 5.0399 ± 0.00008 Å |
| b | 14.26675 ± 0.00016 Å |
| c | 15.137 ± 0.0002 Å |
| α | 82.4456 ± 0.001° |
| β | 83.3581 ± 0.0012° |
| γ | 85.9012 ± 0.0011° |
| Cell volume | 1069.96 ± 0.03 Å3 |
| Cell temperature | 100 ± 0.1 K |
| Ambient diffraction temperature | 100 ± 0.1 K |
| Number of distinct elements | 5 |
| Space group number | 2 |
| Hermann-Mauguin space group symbol | P -1 |
| Hall space group symbol | -P 1 |
| Residual factor for all reflections | 0.0404 |
| Residual factor for significantly intense reflections | 0.0394 |
| Weighted residual factors for significantly intense reflections | 0.1069 |
| Weighted residual factors for all reflections included in the refinement | 0.1079 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.049 |
| Diffraction radiation probe | x-ray |
| Diffraction radiation wavelength | 1.54184 Å |
| Diffraction radiation type | CuKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 295521 (current) | 2024-10-18 | cif/ Adding structures of 1572879, 1572880 via cif-deposit CGI script. |
1572880.cif |
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