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Information card for entry 7007702
Preview
| Coordinates | 7007702.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C26 H37 Br Mn2 N2 O8 |
|---|---|
| Calculated formula | C26 H37 Br Mn2 N2 O8 |
| SMILES | [Br-].c12c(C)cccc1C=[N]1CCC3[O]4[Mn]51(O2)([OH]C)[O]=C(C)O[Mn]14([O]5C)([N](=Cc2c(c(C)ccc2)O1)CC3)[OH]C |
| Title of publication | Synthesis, structure and catalase-like activity of dimanganese(III) complexes of 1,5-bis(X-salicylidenamino)pentan-3-ol (X = 3- and 5-methyl). Influence of phenyl-ring substituents on catalytic activity. |
| Authors of publication | Moreno, Diego; Palopoli, Claudia; Daier, Verónica; Shova, Sergiu; Vendier, Laure; Sierra, Manuel González; Tuchagues, Jean-Pierre; Signorella, Sandra |
| Journal of publication | Dalton transactions (Cambridge, England : 2003) |
| Year of publication | 2006 |
| Journal issue | 43 |
| Pages of publication | 5156 - 5166 |
| a | 14.1784 ± 0.0013 Å |
| b | 20.5223 ± 0.0014 Å |
| c | 10.1765 ± 0.0007 Å |
| α | 90° |
| β | 90° |
| γ | 90° |
| Cell volume | 2961.1 ± 0.4 Å3 |
| Cell temperature | 293 ± 2 K |
| Ambient diffraction temperature | 293 ± 2 K |
| Number of distinct elements | 6 |
| Space group number | 62 |
| Hermann-Mauguin space group symbol | P n m a |
| Hall space group symbol | -P 2ac 2n |
| Residual factor for all reflections | 0.085 |
| Residual factor for significantly intense reflections | 0.0703 |
| Weighted residual factors for significantly intense reflections | 0.1557 |
| Weighted residual factors for all reflections included in the refinement | 0.1617 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.077 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 179781 (current) | 2016-03-25 | cif/7/00/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 7/00/77. |
7007702.cif |
| 120443 | 2014-07-15 | Adding 17924 DOIs guessed from source file names. | 7007702.cif |
| 35909 | 2012-02-26 | cif/7/: reorganising range 7 into a prefix-directory tree. | 7007702.cif |
| 1504 | 2010-09-08 | cif/7/ Adding data extracted from RSC 2005 and 2006 year publications. |
7007702.cif |
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Users of the data should acknowledge the original authors of the
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