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Information card for entry 2240766
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| Coordinates | 2240766.cif |
|---|---|
| Structure factors | 2240766.hkl |
| Original IUCr paper | HTML |
| Chemical name | <i>catena</i>-poly[[[diaquacobalt(II)]-bis(μ-hex-3-enedinitrile-κ^2^<i>N</i>:<i>N</i>')] bis(tetrafluoridoborate)] |
|---|---|
| Formula | C12 H16 B2 Co F8 N4 O2 |
| Calculated formula | C12 H16 B2 Co F8.006 N4 O2 |
| Title of publication | Crystal structure of <i>catena</i>-poly[[[diaquacobalt(II)]-bis(μ-hex-3-enedinitrile-κ^2^<i>N</i>:<i>N</i>')] bis(tetrafluoridoborate)] |
| Authors of publication | Son, Jung-Su; Lim, Sung-Chul; Lee, Hochun; Hong, Seung-Tae |
| Journal of publication | Acta Crystallographica Section E |
| Year of publication | 2015 |
| Journal volume | 71 |
| Journal issue | 6 |
| Pages of publication | m135 - m136 |
| a | 7.9839 ± 0.0011 Å |
| b | 8.3434 ± 0.0011 Å |
| c | 8.8441 ± 0.0013 Å |
| α | 71.38 ± 0.005° |
| β | 88.458 ± 0.005° |
| γ | 66.184 ± 0.004° |
| Cell volume | 507.2 ± 0.12 Å3 |
| Cell temperature | 103 K |
| Ambient diffraction temperature | 103 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 | 0.046 |
| Residual factor for significantly intense reflections | 0.033 |
| Weighted residual factors for all reflections | 0.0848 |
| Weighted residual factors for significantly intense reflections | 0.0843 |
| Weighted residual factors for all reflections included in the refinement | 0.068 |
| Goodness-of-fit parameter for all reflections included in the refinement | 0.87 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | Yes |
| Revision | Date | Message | Files |
|---|---|---|---|
| 181907 (current) | 2016-04-06 | hkl/2/24/ (antanas@echidna) Adding IUCr specific svn headers to multiple entries in subrange 2/24/07 |
2240766.cif 2240766.hkl |
| 176428 | 2016-02-13 | Replaced deprecated COD CIF data names with their more modern alternatives. The _cod_cif_authors_sg_Hall and _cod_cif_authors_sg_H-M data items were renamed to _cod_original_sg_symbol_Hall and _cod_cif_authors_sg_H-M respectively. |
2240766.cif 2240766.hkl |
| 137299 | 2015-05-24 | cif/ hkl/ Adding structures of 2240766 via cif-deposit CGI script. |
2240766.cif 2240766.hkl |
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Users of the data should acknowledge the original authors of the
structural data.