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Information card for entry 2233324
Preview
| Coordinates | 2233324.cif |
|---|---|
| Structure factors | 2233324.hkl |
| Original IUCr paper | HTML |
| Chemical name | Poly[[hexaaqua(μ~2~-oxalato- κ^4^<i>O</i>^1^,<i>O</i>^2^:<i>O</i>^1'^,<i>O</i>^2'^)bis(μ~3~-pyridine- 2,4-dicarboxylato- κ^4^<i>N</i>,<i>O</i>^1^:<i>O</i>^1'^:<i>O</i>^4^)dicerium(III)] monohydrate] |
|---|---|
| Formula | C16 H20 Ce2 N2 O19 |
| Calculated formula | C16 H20 Ce2 N2 O19 |
| Title of publication | Poly[[hexaaqua(μ~2~-oxalato-κ^4^<i>O</i>^1^,<i>O</i>^2^:<i>O</i>^1'^,<i>O</i>^2'^)bis(μ~3~-pyridine-2,4-dicarboxylato-κ^4^<i>N</i>,<i>O</i>^1^:<i>O</i>^1'^:<i>O</i>^4^)dicerium(III)] monohydrate] |
| Authors of publication | Shen, Fwu Ming; Lush, Shie Fu |
| Journal of publication | Acta Crystallographica Section E |
| Year of publication | 2012 |
| Journal volume | 68 |
| Journal issue | 1 |
| Pages of publication | m21 - m22 |
| a | 6.416 ± 0.0005 Å |
| b | 6.6486 ± 0.0006 Å |
| c | 13.992 ± 0.0012 Å |
| α | 89.917 ± 0.001° |
| β | 85.588 ± 0.001° |
| γ | 73.676 ± 0.001° |
| Cell volume | 570.98 ± 0.08 Å3 |
| Cell temperature | 294 K |
| Ambient diffraction temperature | 294 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 | 0.0313 |
| Residual factor for significantly intense reflections | 0.0279 |
| Weighted residual factors for significantly intense reflections | 0.0794 |
| Weighted residual factors for all reflections included in the refinement | 0.0809 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.102 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | Yes |
| Revision | Date | Message | Files |
|---|---|---|---|
| 181255 (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 2/23/33. |
2233324.cif 2233324.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. |
2233324.cif 2233324.hkl |
| 120072 | 2014-07-11 | Adding DOIs to range 2 structures. | 2233324.cif 2233324.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. | 2233324.cif 2233324.hkl |
| 34292 | 2012-02-14 | hkl/ Adding Fobs data for the recently deposited IUCr structures. |
2233324.cif 2233324.hkl |
| 32390 | 2012-02-08 | ../uploads/cif-deposit/cod/cif Adding structures of 2233324 via cif-deposit CGI script. |
2233324.cif |
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Users of the data should acknowledge the original authors of the
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