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Information card for entry 7017196
Preview
| Coordinates | 7017196.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C69 H118 K2 Mn8 N12 O37 |
|---|---|
| Calculated formula | C69 H114 K2 Mn8 N12 O37 |
| Title of publication | Self-assembled decanuclear Na(I)(2)Mn(II)(4)Mn(III)(4) complexes: from discrete clusters to 1-D and 2-D structures, with the Mn(II)(4)Mn(III)(4) unit displaying a large spin ground state and probable SMM behaviour. |
| Authors of publication | Langley, Stuart K.; Chilton, Nicholas F.; Moubaraki, Boujemaa; Murray, Keith S. |
| Journal of publication | Dalton transactions (Cambridge, England : 2003) |
| Year of publication | 2011 |
| Journal volume | 40 |
| Journal issue | 45 |
| Pages of publication | 12201 - 12209 |
| a | 14.798 ± 0.003 Å |
| b | 18.608 ± 0.004 Å |
| c | 18.879 ± 0.004 Å |
| α | 77.06 ± 0.003° |
| β | 75.811 ± 0.005° |
| γ | 82.295 ± 0.005° |
| Cell volume | 4894.7 ± 1.8 Å3 |
| Cell temperature | 123 ± 2 K |
| Ambient diffraction temperature | 123 ± 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 | 0.1367 |
| Residual factor for significantly intense reflections | 0.0975 |
| Weighted residual factors for significantly intense reflections | 0.2446 |
| Weighted residual factors for all reflections included in the refinement | 0.272 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.046 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 179875 (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 7/01/71. |
7017196.cif |
| 120112 | 2014-07-12 | Adding DOIs to range 7 structures. | 7017196.cif |
| 35909 | 2012-02-26 | cif/7/: reorganising range 7 into a prefix-directory tree. | 7017196.cif |
| 31269 | 2011-12-13 | ../uploads/cif-deposit/cod/cif Adding structures of 7017192, 7017193, 7017194, 7017195, 7017196, 7017197, 7017198, 7017199 via cif-deposit CGI script. |
7017196.cif |
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