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Information card for entry 7015596
Preview
| Coordinates | 7015596.cif |
|---|---|
| Original paper (by DOI) | HTML |
| 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 |
| Revision | Date | Message | Files |
|---|---|---|---|
| 179859 (current) | 2016-03-25 | cif/7/01/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 7/01/55. |
7015596.cif |
| 120112 | 2014-07-12 | Adding DOIs to range 7 structures. | 7015596.cif |
| 35909 | 2012-02-26 | cif/7/: reorganising range 7 into a prefix-directory tree. | 7015596.cif |
| 21200 | 2011-06-21 | ../uploads/cif-deposit/cod/cif Adding structures of 7015594, 7015595, 7015596, 7015597, 7015598 via cif-deposit CGI script. |
7015596.cif |
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