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Information card for entry 2008358
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| Coordinates | 2008358.cif |
|---|---|
| Original IUCr paper | HTML |
| Formula | C28 H27 N O6 |
|---|---|
| Calculated formula | C28 H27 N O6 |
| SMILES | o1c(cc(=O)c2cc(C3C(=C(NC(=C3C(=O)OCC)C)C)C(=O)OCC)ccc12)c1ccccc1 |
| Title of publication | A flavone 1,4-dihydropyridine calcium antagonist |
| Authors of publication | Özbey, Süheyla; Kendi, Engin; Kılcıgil Ayhan, Gülgün; Ertan, Rahmiye |
| Journal of publication | Acta Crystallographica Section C |
| Year of publication | 1999 |
| Journal volume | 55 |
| Journal issue | 4 |
| Pages of publication | 678 - 680 |
| a | 9.9152 ± 0.0006 Å |
| b | 11.0521 ± 0.0007 Å |
| c | 13.763 ± 0.001 Å |
| α | 69.6 ± 0.005° |
| β | 73.969 ± 0.006° |
| γ | 65.035 ± 0.005° |
| Cell volume | 1266.67 ± 0.16 Å3 |
| Cell temperature | 295 K |
| Number of distinct elements | 4 |
| Space group number | 2 |
| Hermann-Mauguin space group symbol | P -1 |
| Hall space group symbol | -P 1 |
| Residual factor for significantly intense reflections | 0.047 |
| Weighted residual factors for significantly intense reflections | 0.054 |
| Goodness-of-fit parameter for significantly intense reflections | 1.05 |
| Diffraction radiation wavelength | 0.71069 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
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