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Information card for entry 4304212
Preview
| Coordinates | 4304212.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C71 H165 Mn5 N O0.5 P7 Si9 |
|---|---|
| Calculated formula | C71 H165 Mn5 N O0.5 P7 Si9 |
| Title of publication | Unique Manganese Phosphorus Complex with a Mn5P7 Core: Synthesis, Molecular Structure, and Magnetic Properties |
| Authors of publication | Carsten von Hänisch; Florian Weigend; Rodolphe Clérac |
| Journal of publication | Inorganic Chemistry |
| Year of publication | 2008 |
| Journal volume | 47 |
| Pages of publication | 1460 - 1464 |
| a | 14.567 ± 0.003 Å |
| b | 17.121 ± 0.003 Å |
| c | 21.248 ± 0.004 Å |
| α | 96.01 ± 0.03° |
| β | 91.81 ± 0.03° |
| γ | 99.59 ± 0.03° |
| Cell volume | 5190 ± 1.8 Å3 |
| Cell temperature | 180 ± 2 K |
| Ambient diffraction temperature | 180 ± 2 K |
| Number of distinct elements | 7 |
| Space group number | 2 |
| Hermann-Mauguin space group symbol | P -1 |
| Hall space group symbol | -P 1 |
| Residual factor for all reflections | 0.0861 |
| Residual factor for significantly intense reflections | 0.0684 |
| Weighted residual factors for significantly intense reflections | 0.1855 |
| Weighted residual factors for all reflections included in the refinement | 0.2043 |
| Goodness-of-fit parameter for all reflections included in the refinement | 0.987 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 176467 (current) | 2016-02-16 | cif/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in range 4. |
4304212.cif |
| 120081 | 2014-07-12 | Adding DOIs to range 4/30 structures. | 4304212.cif |
| 34330 | 2012-02-24 | cif/4/ Reorganising CIF range 4 into a prefix tree. |
4304212.cif |
| 32063 | 2012-01-26 | cif/4 Correction of volume and publication year for files coming from a couple of issues of Inorg. Chem. The mistake was made when fetching bibliography for these entries and detected just now. I have checked that all other Inorg. Chem. files are correct. |
4304212.cif |
| 1163 | 2010-05-11 | cif/4/: committing data from the Inorg-Chem-2008_01-12/ deposition. | 4304212.cif |
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Users of the data should acknowledge the original authors of the
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