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Information card for entry 2240904
Preview
| Coordinates | 2240904.cif |
|---|---|
| Structure factors | 2240904.hkl |
| Original IUCr paper | HTML |
| External links | PubChem |
| Chemical name | Bis(μ-3-carboxy-6-methylpyridine-2-carboxylato)-κ^3^<i>N</i>,<i>O</i>^2^:<i>O</i>^2^;κ^3^<i>O</i>^2^:<i>N</i>,<i>O</i>^2^-bis[(2,2'-bipyridine-κ^2^<i>N</i>,<i>N</i>'))(nitrato-κ<i>O</i>)cadmium] methanol monosolvate |
|---|---|
| Formula | C37 H32 Cd2 N8 O15 |
| Calculated formula | C37 H32 Cd2 N8 O15 |
| Title of publication | Structure of a dinuclear cadmium complex with 2,2'-bipyridine, monodentate nitrate and 3-carboxy-6-methylpyridine-2-carboxylate ligands: intramolecular carbonyl(lone pair)···π(ring) and nitrate(π)···π(ring) interactions. |
| Authors of publication | Granifo, Juan; Suarez, Sebastián; Baggio, Ricardo |
| Journal of publication | Acta Crystallographica Section E |
| Year of publication | 2015 |
| Journal volume | 71 |
| Journal issue | 8 |
| Pages of publication | 890 - 894 |
| a | 8.4096 ± 0.0005 Å |
| b | 10.9626 ± 0.0006 Å |
| c | 11.5056 ± 0.0004 Å |
| α | 71.241 ± 0.004° |
| β | 86.537 ± 0.004° |
| γ | 86.803 ± 0.005° |
| Cell volume | 1001.79 ± 0.09 Å3 |
| Cell temperature | 295 ± 2 K |
| Ambient diffraction temperature | 295 ± 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 | 0.0462 |
| Residual factor for significantly intense reflections | 0.0359 |
| Weighted residual factors for significantly intense reflections | 0.0846 |
| Weighted residual factors for all reflections included in the refinement | 0.092 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.011 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | Yes |
| Revision | Date | Message | Files |
|---|---|---|---|
| 301807 (current) | 2025-08-19 | Add cross-references to PubChem compounds in COD range 2/24 Each referenced PubChem compound corresponds to the full crystal structure. |
2240904.cif 2240904.hkl |
| 181909 | 2016-04-06 | hkl/2/24/ (antanas@echidna) Adding IUCr specific svn headers to multiple entries in subrange 2/24/09 |
2240904.cif 2240904.hkl |
| 140988 | 2015-07-08 | cif/ hkl/ Adding structures of 2240904 via cif-deposit CGI script. |
2240904.cif 2240904.hkl |
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