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Information card for entry 4104494
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| Coordinates | 4104494.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Common name | catena-(Me2NH2)[Fe2(HCOO)6] |
|---|---|
| Chemical name | catena-(Dimethylammonium bis(μ~2~-formato-O,O')-iron(ii)-iron(iii) |
| Formula | C8 H18 Fe2 N O12 |
| Calculated formula | C8 H13.98 Fe2 N0.99 O12 |
| Title of publication | Intensely Colored Mixed-Valence Iron(II) Iron(III) Formate Analogue of Prussian Blue Exhibits Néel N-Type Ferrimagnetism |
| Authors of publication | Karl S. Hagen; Sunil G. Naik; Boi Hanh Huynh; Antonio Masello; George Christou |
| Journal of publication | Journal of the American Chemical Society |
| Year of publication | 2009 |
| Journal volume | 131 |
| Pages of publication | 7516 - 7517 |
| a | 8.2512 ± 0.0011 Å |
| b | 8.2512 ± 0.0011 Å |
| c | 13.846 ± 0.003 Å |
| α | 90° |
| β | 90° |
| γ | 120° |
| Cell volume | 816.4 ± 0.2 Å3 |
| Cell temperature | 173 ± 2 K |
| Ambient diffraction temperature | 173 ± 2 K |
| Number of distinct elements | 5 |
| Space group number | 163 |
| Hermann-Mauguin space group symbol | P -3 1 c |
| Hall space group symbol | -P 3 2c |
| Residual factor for all reflections | 0.0305 |
| Residual factor for significantly intense reflections | 0.0279 |
| Weighted residual factors for significantly intense reflections | 0.0747 |
| Weighted residual factors for all reflections included in the refinement | 0.0765 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.052 |
| Diffraction radiation probe | x-ray |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 176432 (current) | 2016-02-14 | cif/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries. |
4104494.cif |
| 120076 | 2014-07-11 | Adding DOIs to range 4/10 structures. | 4104494.cif |
| 34330 | 2012-02-24 | cif/4/ Reorganising CIF range 4 into a prefix tree. |
4104494.cif |
| 29518 | 2011-11-03 | ../uploads/cif-deposit/cod/cif Adding structures of 4104494 via cif-deposit CGI script. |
4104494.cif |
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Users of the data should acknowledge the original authors of the
structural data.