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Information card for entry 2018288
Preview
| Coordinates | 2018288.cif |
|---|---|
| Structure factors | 2018288.hkl |
| Original IUCr paper | HTML |
| Chemical name | Poly[4,4'-(propane-1,3-diyl)dipyridinium bis{tetraaquabis(μ~2~-benzene-1,2,4,5-tetracarboxylato)bis[μ~2~-1,3- bis(4-pyridyl)propane]dicobalt(II)} pentahydrate] |
|---|---|
| Formula | C59 H68 Co2 N6 O25 |
| Calculated formula | C59 H68 Co2 N6 O25 |
| Title of publication | Poly[4,4'-(propane-1,3-diyl)dipyridinium bis{tetraaquabis(μ~2~-5-carboxybenzene-1,2,4-tricarboxylato)bis[μ~2~-1,3-bis(4-pyridyl)propane]dicobalt(II)} pentahydrate] |
| Authors of publication | Atria, Ana María; Corsini, Gino; Garland, Maria Teresa; Baggio, Ricardo |
| Journal of publication | Acta Crystallographica Section C |
| Year of publication | 2011 |
| Journal volume | 67 |
| Journal issue | 11 |
| Pages of publication | m367 - m370 |
| a | 18.068 ± 0.004 Å |
| b | 9.346 ± 0.002 Å |
| c | 18.209 ± 0.004 Å |
| α | 90° |
| β | 96.421 ± 0.006° |
| γ | 90° |
| Cell volume | 3055.5 ± 1.2 Å3 |
| Cell temperature | 150 ± 2 K |
| Ambient diffraction temperature | 150 ± 2 K |
| Number of distinct elements | 5 |
| Space group number | 13 |
| Hermann-Mauguin space group symbol | P 1 2/n 1 |
| Hall space group symbol | -P 2yac |
| Residual factor for all reflections | 0.057 |
| Residual factor for significantly intense reflections | 0.0423 |
| Weighted residual factors for significantly intense reflections | 0.1054 |
| Weighted residual factors for all reflections included in the refinement | 0.115 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.034 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | Yes |
| Revision | Date | Message | Files |
|---|---|---|---|
| 180851 (current) | 2016-04-02 | cif/2/01/ (antanas@echidna) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 2/01/82. |
2018288.cif 2018288.hkl |
| 176760 | 2016-02-20 | cif/2/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 2/01. |
2018288.cif 2018288.hkl |
| 125873 | 2014-10-25 | cod/ (saulius@koala.ibt.lt) Adding DOIs to 1887 Acta Cryst. CIFs, their DOIs fetched using ACCE codes. |
2018288.cif 2018288.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. | 2018288.cif 2018288.hkl |
| 31968 | 2012-01-03 | hkl/ Adding automatically assigned IUCr Fobs data for the rest of the year 2001 structures. |
2018288.cif 2018288.hkl |
| 30899 | 2011-12-12 | ../uploads/cif-deposit/cod/cif Adding structures of 2018288 via cif-deposit CGI script. |
2018288.cif |
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Users of the data should acknowledge the original authors of the
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