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Information card for entry 7203728
Preview
| Coordinates | 7203728.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C46 H37 Cl5 N2 O3 Os S32 |
|---|---|
| Calculated formula | C45.976 H36.98 Cl5 N1.996 O2.992 Os S32 |
| Title of publication | Variety of molecular conducting layers in the family of radical cation salts based on BEDT-TTF with the metal mononitrosyl complex [OsNOCl5]2‒ |
| Authors of publication | Simonov, Sergey V.; Shevyakova, Irina Yu.; Zorina, Leokadiya V.; Khasanov, Salavat S.; Buravov, Lev I.; Emel'yanov, Vyacheslav A.; Canadell, Enric; Shibaeva, Rimma P.; Yagubskii, Eduard B. |
| Journal of publication | Journal of Materials Chemistry |
| Year of publication | 2005 |
| Journal volume | 15 |
| Journal issue | 25 |
| Pages of publication | 2476 |
| a | 9.6275 ± 0.0006 Å |
| b | 11.1599 ± 0.0006 Å |
| c | 18.064 ± 0.001 Å |
| α | 101.478 ± 0.005° |
| β | 91.926 ± 0.006° |
| γ | 110.894 ± 0.005° |
| Cell volume | 1765.31 ± 0.19 Å3 |
| Cell temperature | 293 ± 2 K |
| Ambient diffraction temperature | 292 ± 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 | 0.039 |
| Residual factor for significantly intense reflections | 0.0329 |
| Weighted residual factors for significantly intense reflections | 0.0793 |
| Weighted residual factors for all reflections included in the refinement | 0.0941 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.085 |
| Diffraction radiation probe | x-ray |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | Mokα |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 180368 (current) | 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 7/20/37. |
7203728.cif |
| 120112 | 2014-07-12 | Adding DOIs to range 7 structures. | 7203728.cif |
| 35909 | 2012-02-26 | cif/7/: reorganising range 7 into a prefix-directory tree. | 7203728.cif |
| 1504 | 2010-09-08 | cif/7/ Adding data extracted from RSC 2005 and 2006 year publications. |
7203728.cif |
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Users of the data should acknowledge the original authors of the
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