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Information card for entry 2237504
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| Coordinates | 2237504.cif |
|---|---|
| Structure factors | 2237504.hkl |
| Original IUCr paper | HTML |
| Chemical name | Poly[[bis{μ~2~-1,2-bis[(1<i>H</i>-imidazol-1-yl)methyl]benzene}(μ~4~- 9,10-dioxo-9,10-dihydroanthracene-1,4,5,8-tetracarboxylato)dicobalt(II)] monohydrate] |
|---|---|
| Formula | C46 H36 Co2 N8 O12 |
| Calculated formula | C46 H36 Co2 N8 O12 |
| Title of publication | Poly[[bis{μ~2~-1,2-bis[(1<i>H</i>-imidazol-1-yl)methyl]benzene}(μ~4~-9,10-dioxo-9,10-dihydroanthracene-1,4,5,8-tetracarboxylato)dicobalt(II)] dihydrate] |
| Authors of publication | Sheng, Xiao-Li; Xu, Duo-Hui; Cai, Bin; Liu, Jian-Lan |
| Journal of publication | Acta Crystallographica Section E |
| Year of publication | 2013 |
| Journal volume | 69 |
| Journal issue | 3 |
| Pages of publication | m136 |
| a | 9.561 ± 0.004 Å |
| b | 10.594 ± 0.005 Å |
| c | 12.436 ± 0.005 Å |
| α | 107.095 ± 0.007° |
| β | 102.454 ± 0.006° |
| γ | 106.551 ± 0.006° |
| Cell volume | 1090.7 ± 0.8 Å3 |
| Cell temperature | 296 ± 2 K |
| Ambient diffraction temperature | 296 ± 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 | 0.0375 |
| Residual factor for significantly intense reflections | 0.0324 |
| Weighted residual factors for significantly intense reflections | 0.0871 |
| Weighted residual factors for all reflections included in the refinement | 0.0905 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.044 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | Yes |
| Revision | Date | Message | Files |
|---|---|---|---|
| 181297 (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 2/23/75. |
2237504.cif 2237504.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. |
2237504.cif 2237504.hkl |
| 88055 | 2013-08-28 | cod/cif/ (saulius@koala.ibt.lt) Adding the _cod_database_fobs_code links for those COD CIFs that have their Fobs deposited recently. |
2237504.cif 2237504.hkl |
| 88054 | 2013-08-28 | cod/hkl/ (saulius@koala.ibt.lt) Adding Fobs files for the recently deposited IUCr coordinate data. |
2237504.cif 2237504.hkl |
| 78796 | 2013-04-02 | cif/ Adding structures of 2237504 via cif-deposit CGI script. |
2237504.cif |
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Users of the data should acknowledge the original authors of the
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