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CIF Information Card
Information card for 7151777
7151776 << 7151777 >> 7151778Preview
|
Coordinates |
7151777.cif |
Structure parameters
| Formula | - C45 H33 N5 O3 - |
| Calculated formula | - C45 H33 N5 O3 - |
| Title of publication | Unexpected hydroxylamine-induced ring-closure reactions of meso-tetraphenylsecochlorin bisaldehyde. |
| Authors of publication | Akhigbe, Joshua; Peters, Gretchen; Zeller, Matthias; Brückner, Christian |
| Journal of publication | Organic & biomolecular chemistry |
| Year of publication | 2011 |
| Journal volume | 9 |
| Journal issue | 7 |
| Pages of publication | 2306 - 2313 |
| a | 38.963 ± 0.016 Å |
| b | 9.07 ± 0.004 Å |
| c | 25.863 ± 0.011 Å |
| α | 90° |
| β | 130.953 ± 0.005° |
| γ | 90° |
| Cell volume | 6903 ± 5 Å3 |
| Cell temperature | 100 ± 2 K |
| Ambient diffraction temperature | 100 ± 2 K |
| Number of distinct elements | 4 |
| Hermann-Mauguin symmetry space group | C 1 2/c 1 |
| Hall symmetry space group | -C 2yc |
| Residual factor for all reflections | 0.1951 |
| Residual factor for observed reflections | 0.0855 |
| Weighted residual factors for the observed reflections | 0.2202 |
| Weighted residual factors for all reflections included in the refinement | 0.2784 |
| Goodness-of-fit parameter for observed reflections | 0.961 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |