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CIF Information Card
Information card for 7015598
7015597 << 7015598 >> 7015599Preview
|
Coordinates |
7015598.cif |
Structure parameters
| Formula | - C41 H48 Cl3 Fe N10 O13 - |
| Calculated formula | - C41 H48 Cl3 Fe N10 O13 - |
| Title of publication | Syntheses, structures and properties of a series of non-heme alkoxide-Fe(III) complexes of a benzimidazolyl-rich ligand as models for lipoxygenase. |
| Authors of publication | Wu, Guiling; Mei, Fusheng; Gao, Qian; Han, Fang; Lan, Shemin; Zhang, Jianming; Li, Dongfeng |
| Journal of publication | Dalton transactions (Cambridge, England : 2003) |
| Year of publication | 2011 |
| Journal volume | 40 |
| Journal issue | 24 |
| Pages of publication | 6433 - 6439 |
| a | 12.203 ± 0.004 Å |
| b | 13.723 ± 0.005 Å |
| c | 19.511 ± 0.006 Å |
| α | 95.8751 ± 0.0019° |
| β | 102.746 ± 0.003° |
| γ | 114.876 ± 0.004° |
| Cell volume | 2820 ± 1.6 Å3 |
| Cell temperature | 173 ± 2 K |
| Ambient diffraction temperature | 173 ± 2 K |
| Number of distinct elements | 6 |
| Hermann-Mauguin symmetry space group | P -1 |
| Hall symmetry space group | -P 1 |
| Residual factor for all reflections | 0.0712 |
| Residual factor for observed reflections | 0.0643 |
| Weighted residual factors for the observed reflections | 0.1769 |
| Weighted residual factors for all reflections included in the refinement | 0.1835 |
| Goodness-of-fit parameter for observed reflections | 1.071 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | No |