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Information card for entry 2236652
Preview
| Coordinates | 2236652.cif |
|---|---|
| Structure factors | 2236652.hkl |
| Original IUCr paper | HTML |
| External links | PubChem |
| Chemical name | <i>cis</i>-(2,2'-Bipyridine-κ^2^<i>N</i>,<i>N</i>')bis(isonicotinamide- κ<i>N</i>^1^)palladium(II) bis(hexafluoridophosphate) |
|---|---|
| Formula | C22 H20 F12 N6 O2 P2 Pd |
| Calculated formula | C22 H20 F12 N6 O2 P2 Pd |
| Title of publication | <i>cis</i>-(2,2'-Bipyridine-κ^2^<i>N</i>,<i>N</i>')bis(isonicotinamide-κ<i>N</i>^1^)palladium(II) bis(hexafluoridophosphate) |
| Authors of publication | Adrian, Rafael A.; Quintela, Brayan; Powell, Douglas R.; Ng, Seik Weng; Tiekink, Edward R. T. |
| Journal of publication | Acta Crystallographica Section E |
| Year of publication | 2012 |
| Journal volume | 68 |
| Journal issue | 11 |
| Pages of publication | m1390 - m1391 |
| a | 22.592 ± 0.0014 Å |
| b | 13.8299 ± 0.0008 Å |
| c | 17.9092 ± 0.0012 Å |
| α | 90° |
| β | 95.269 ± 0.008° |
| γ | 90° |
| Cell volume | 5572 ± 0.6 Å3 |
| Cell temperature | 100 ± 2 K |
| Ambient diffraction temperature | 100 ± 2 K |
| Number of distinct elements | 7 |
| Space group number | 15 |
| Hermann-Mauguin space group symbol | C 1 2/c 1 |
| Hall space group symbol | -C 2yc |
| Residual factor for all reflections | 0.074 |
| Residual factor for significantly intense reflections | 0.0523 |
| Weighted residual factors for significantly intense reflections | 0.1332 |
| Weighted residual factors for all reflections included in the refinement | 0.1466 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.01 |
| Diffraction radiation wavelength | 1.54178 Å |
| Diffraction radiation type | CuKα |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | Yes |
| Revision | Date | Message | Files |
|---|---|---|---|
| 301806 (current) | 2025-08-19 | Add cross-references to PubChem compounds in COD range 2/23 Each referenced PubChem compound corresponds to the full crystal structure. |
2236652.cif 2236652.hkl |
| 181288 | 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 2/23/66. |
2236652.cif 2236652.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. |
2236652.cif 2236652.hkl |
| 120072 | 2014-07-11 | Adding DOIs to range 2 structures. | 2236652.cif 2236652.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. | 2236652.cif 2236652.hkl |
| 74188 | 2013-02-22 | hkl/ Adding the rest of the Fobs data for the structures publishe din the IUCr journals in 2012 and in January of 2013. |
2236652.cif 2236652.hkl |
| 70247 | 2012-12-21 | cif/ Adding structures of 2236652 via cif-deposit CGI script. |
2236652.cif |
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Users of the data should acknowledge the original authors of the
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