Information card for entry 7015596
| Formula |
C42 H49 Cl3 Fe N11 O13 |
| Calculated formula |
C42 H49 Cl3 Fe N11 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 |
12.386 ± 0.003 Å |
| b |
14.209 ± 0.002 Å |
| c |
14.775 ± 0.003 Å |
| α |
73.413 ± 0.016° |
| β |
72.856 ± 0.014° |
| γ |
75.288 ± 0.016° |
| Cell volume |
2340.1 ± 0.8 Å3 |
| Cell temperature |
173 ± 2 K |
| Ambient diffraction temperature |
173 ± 2 K |
| Number of distinct elements |
6 |
| Space group number |
2 |
| Hermann-Mauguin space group symbol |
P -1 |
| Hall space group symbol |
-P 1 |
| Residual factor for all reflections |
0.0892 |
| Residual factor for significantly intense reflections |
0.0777 |
| Weighted residual factors for significantly intense reflections |
0.2217 |
| Weighted residual factors for all reflections included in the refinement |
0.2325 |
| Goodness-of-fit parameter for all reflections included in the refinement |
1.063 |
| Diffraction radiation wavelength |
0.71073 Å |
| Diffraction radiation type |
MoKα |
| Has coordinates |
Yes |
| Has disorder |
Yes |
| Has Fobs |
No |
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