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Information card for entry 7201317
Preview
| Coordinates | 7201317.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C10 H38 N8 Na2 O19 |
|---|---|
| Calculated formula | C10 H38 N8 Na2 O19 |
| Title of publication | Structure and magnetism of a verdazyl radical clathrate hydrate. Strong intermolecular magnetic interactions derived from π-stacking within ice-like channels |
| Authors of publication | Gilroy, Joe B.; Lemaire, Martin T.; Patrick, Brian O.; Hicks, Robin G. |
| Journal of publication | CrystEngComm |
| Year of publication | 2009 |
| Journal volume | 11 |
| Journal issue | 10 |
| Pages of publication | 2180 |
| a | 22.9263 ± 0.0011 Å |
| b | 6.4164 ± 0.0004 Å |
| c | 20.1881 ± 0.001 Å |
| α | 90° |
| β | 109.039 ± 0.003° |
| γ | 90° |
| Cell volume | 2807.3 ± 0.3 Å3 |
| Cell temperature | 173 ± 2 K |
| Ambient diffraction temperature | 173 ± 2 K |
| Number of distinct elements | 5 |
| Space group number | 14 |
| Hermann-Mauguin space group symbol | P 1 21/c 1 |
| Hall space group symbol | -P 2ybc |
| Residual factor for all reflections | 0.1006 |
| Residual factor for significantly intense reflections | 0.0467 |
| Weighted residual factors for significantly intense reflections | 0.0959 |
| Weighted residual factors for all reflections included in the refinement | 0.115 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.009 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 273632 (current) | 2022-03-11 | cif/7/20/13/ Corrected the '_chemical_formula_sum' data item value in entry 7201317 by removing an extra trailing single quote symbol ("'"). |
7201317.cif |
| 180344 | 2016-03-26 | cif/7/20/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 7/20/13. |
7201317.cif |
| 120112 | 2014-07-12 | Adding DOIs to range 7 structures. | 7201317.cif |
| 35909 | 2012-02-26 | cif/7/: reorganising range 7 into a prefix-directory tree. | 7201317.cif |
| 1167 | 2010-05-13 | cif/ Adding data from the rest of 2009 RSC journals, Inorg-Chem-2008 and Chem-Comm-2010_18-19. |
7201317.cif |
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Users of the data should acknowledge the original authors of the
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