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Information card for entry 2229340
Preview
| Coordinates | 2229340.cif |
|---|---|
| Structure factors | 2229340.hkl |
| Original IUCr paper | HTML |
| Chemical name | [Bis(2-pyridyl)amine-κ^2^<i>N</i>,<i>N</i>'](carbonato- κ^2^<i>O</i>,<i>O</i>')cobalt(III) nitrate |
|---|---|
| Formula | C21 H18 Co N7 O6 |
| Calculated formula | C21 H18 Co N7 O6 |
| SMILES | [Co]123(OC(=O)O1)([n]1ccccc1Nc1[n]3cccc1)[n]1ccccc1Nc1[n]2cccc1.O=N(=O)[O-] |
| Title of publication | [Bis(2-pyridyl)amine-<i>N</i>,<i>N</i>'](nitrato-<i>O</i>,<i>O</i>')cobalt(II) nitrate. Corrigendum |
| Authors of publication | Castillo, Oscar; Luque, Antonio; De la Pinta, Noelia; Román, Pascual |
| Journal of publication | Acta Crystallographica Section E |
| Year of publication | 2011 |
| Journal volume | 67 |
| Journal issue | 3 |
| Pages of publication | e15 |
| a | 17.191 ± 0.003 Å |
| b | 7.308 ± 0.001 Å |
| c | 17.843 ± 0.005 Å |
| α | 90° |
| β | 104.94 ± 0.03° |
| γ | 90° |
| Cell volume | 2165.9 ± 0.8 Å3 |
| Cell temperature | 293 ± 2 K |
| Ambient diffraction temperature | 293 ± 2 K |
| Number of distinct elements | 5 |
| Space group number | 14 |
| Hermann-Mauguin space group symbol | P 1 21/n 1 |
| Hall space group symbol | -P 2yn |
| Residual factor for all reflections | 0.0617 |
| Residual factor for significantly intense reflections | 0.0311 |
| Weighted residual factors for significantly intense reflections | 0.0669 |
| Weighted residual factors for all reflections included in the refinement | 0.0756 |
| Goodness-of-fit parameter for all reflections included in the refinement | 0.819 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | Yes |
| Revision | Date | Message | Files |
|---|---|---|---|
| 181214 (current) | 2016-04-03 | hkl/2/22/ (antanas@echidna) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 2/22/93. |
2229340.cif 2229340.hkl |
| 176789 | 2016-02-20 | cif/2/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 2/22. |
2229340.cif 2229340.hkl |
| 120072 | 2014-07-11 | Adding DOIs to range 2 structures. | 2229340.cif 2229340.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. | 2229340.cif 2229340.hkl |
| 26848 | 2011-09-28 | cif/2/, hkl/2/, html/ Reorganising CIFs of the range 2* into the "prefix-directory" tree. |
2229340.cif 2229340.hkl |
| 17966 | 2011-04-13 | hkl/: adding the rest of Fobs files for the recent IUCr deposit. | 2229340.cif 2229340.hkl |
| 17385 | 2011-04-07 | ../uploads/cif-deposit/cod/cif Adding structures of 2229340 via cif-deposit CGI script. |
2229340.cif |
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Users of the data should acknowledge the original authors of the
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