Crystallography Open Database
| COD Home |
|---|
| Accessing COD Data |
|---|
| Add Your Data |
|---|
| Documentation |
|---|
CIF Information Card
Information card for 7151778
7151777 << 7151778 >> 7151779Preview
|
Coordinates |
7151778.cif |
Structure parameters
| Formula | - C43 H29 N5 - |
| Calculated formula | - C43.006 H29.006 N4.994 - |
| 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 | 6.334 ± 0.002 Å |
| b | 10.352 ± 0.003 Å |
| c | 12.149 ± 0.004 Å |
| α | 94.288 ± 0.005° |
| β | 99.895 ± 0.005° |
| γ | 101.107 ± 0.005° |
| Cell volume | 765.2 ± 0.4 Å3 |
| Cell temperature | 100 ± 2 K |
| Ambient diffraction temperature | 100 ± 2 K |
| Number of distinct elements | 3 |
| Hermann-Mauguin symmetry space group | P -1 |
| Hall symmetry space group | -P 1 |
| Residual factor for all reflections | 0.1223 |
| Residual factor for observed reflections | 0.0615 |
| Weighted residual factors for the observed reflections | 0.1457 |
| Weighted residual factors for all reflections included in the refinement | 0.1625 |
| Goodness-of-fit parameter for observed reflections | 1.092 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | No |