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Information card for entry 7006464
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| Coordinates | 7006464.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Common name | catena-(aquo-bis(1,10-phenanthroline)-manganese(ii)-squarate) tetrahydrate |
|---|---|
| Chemical name | catena-[aquo-bis(1,10-phenanthroline)-manganese(II)-squarate] tetrahydrate |
| Formula | C28 H26 Mn N4 O9 |
| Calculated formula | C28 H24 Mn N4 O9 |
| Title of publication | Structural diversity in manganese squarate frameworks using N,N-donor chelating/bridging ligands: syntheses, crystal structures and magnetic properties. |
| Authors of publication | Ghosh, Ananta Kumar; Ghoshal, Debajyoti; Zangrando, Ennio; Ribas, Joan; Chaudhuri, Nirmalendu Ray |
| Journal of publication | Dalton transactions (Cambridge, England : 2003) |
| Year of publication | 2006 |
| Journal issue | 12 |
| Pages of publication | 1554 - 1563 |
| a | 10.017 ± 0.003 Å |
| b | 11.446 ± 0.004 Å |
| c | 13.4 ± 0.004 Å |
| α | 92.59 ± 0.02° |
| β | 101.83 ± 0.02° |
| γ | 110.98 ± 0.02° |
| Cell volume | 1392.2 ± 0.8 Å3 |
| Cell temperature | 293 ± 2 K |
| Ambient diffraction temperature | 293 ± 2 K |
| Number of distinct elements | 5 |
| Space group number | 2 |
| Hermann-Mauguin space group symbol | P -1 |
| Hall space group symbol | -P 1 |
| Residual factor for all reflections | 0.0768 |
| Residual factor for significantly intense reflections | 0.0439 |
| Weighted residual factors for significantly intense reflections | 0.102 |
| Weighted residual factors for all reflections included in the refinement | 0.1131 |
| Goodness-of-fit parameter for all reflections included in the refinement | 0.894 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | Mokα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 179768 (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 7/00/64. |
7006464.cif |
| 120443 | 2014-07-15 | Adding 17924 DOIs guessed from source file names. | 7006464.cif |
| 35909 | 2012-02-26 | cif/7/: reorganising range 7 into a prefix-directory tree. | 7006464.cif |
| 1504 | 2010-09-08 | cif/7/ Adding data extracted from RSC 2005 and 2006 year publications. |
7006464.cif |
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Users of the data should acknowledge the original authors of the
structural data.