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Information card for entry 2234917
Preview
| Coordinates | 2234917.cif |
|---|---|
| Structure factors | 2234917.hkl |
| Original IUCr paper | HTML |
| Chemical name | Poly[[bis[μ-1,2-bis(pyridin-4-yl)ethene- κ^2^<i>N</i>:<i>N</i>']bis(thiocyanato-κ<i>N</i>)cobalt(II)] 1,2-bis(pyridin-4-yl)ethene monosolvate] |
|---|---|
| Formula | C38 H30 Co N8 S2 |
| Calculated formula | C38 H30 Co N8 S2 |
| Title of publication | A triclinic polymorph of poly[[bis[μ-1,2-bis(pyridin-4-yl)ethene-κ^2^<i>N</i>:<i>N</i>']bis(thiocyanato-κ<i>N</i>)cobalt(II)] 1,2-bis(pyridin-4-yl)ethene monosolvate] |
| Authors of publication | Wöhlert, Susanne; Jess, Inke; Näther, Christian |
| Journal of publication | Acta Crystallographica Section E |
| Year of publication | 2012 |
| Journal volume | 68 |
| Journal issue | 6 |
| Pages of publication | m733 - m734 |
| a | 13.7954 ± 0.0014 Å |
| b | 13.8916 ± 0.0013 Å |
| c | 27.848 ± 0.002 Å |
| α | 99.892 ± 0.01° |
| β | 90.547 ± 0.011° |
| γ | 91.269 ± 0.011° |
| Cell volume | 5255.7 ± 0.8 Å3 |
| Cell temperature | 170 ± 2 K |
| Ambient diffraction temperature | 170 ± 2 K |
| Number of distinct elements | 5 |
| Space group number | 2 |
| Hermann-Mauguin space group symbol | P -1 |
| Hall space group symbol | -P 1 |
| Residual factor for all reflections | 0.0804 |
| Residual factor for significantly intense reflections | 0.0541 |
| Weighted residual factors for significantly intense reflections | 0.1551 |
| Weighted residual factors for all reflections included in the refinement | 0.166 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.025 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | Yes |
| Revision | Date | Message | Files |
|---|---|---|---|
| 181271 (current) | 2016-04-03 | hkl/2/23/ (antanas@echidna) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 2/23/49. |
2234917.cif 2234917.hkl |
| 176798 | 2016-02-21 | cif/2/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 2/23. |
2234917.cif 2234917.hkl |
| 120072 | 2014-07-11 | Adding DOIs to range 2 structures. | 2234917.cif 2234917.hkl |
| 88064 | 2013-08-29 | Adding _cod_database_fobs_code data item to all COD CIFs that have Fobs deposited and did not have this data item yet. | 2234917.cif 2234917.hkl |
| 66590 | 2012-09-11 | hkl/ Adding assigned .htl files for the most recent IUCr data depositions. |
2234917.cif 2234917.hkl |
| 61534 | 2012-07-05 | cif/ Adding structures of 2234917 via cif-deposit CGI script. |
2234917.cif |
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Users of the data should acknowledge the original authors of the
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