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Information card for entry 4072445
Preview
| Coordinates | 4072445.cif |
|---|---|
| Original paper (by DOI) | HTML |
| External links | PubChem |
| Formula | C48.25 H42.25 Cl5.75 F N2 P2 Pt |
|---|---|
| Calculated formula | C48.25 H42.25 Cl5.75 F N2 P2 Pt |
| Title of publication | Synthesis of Mixed NHC/L Platinum(II) Complexes: Restricted Rotation of the NHC Group |
| Authors of publication | Newman, Christopher P.; Deeth, Robert J.; Clarkson, Guy J.; Rourke, Jonathan P. |
| Journal of publication | Organometallics |
| Year of publication | 2007 |
| Journal volume | 26 |
| Journal issue | 25 |
| Pages of publication | 6225 |
| a | 14.3923 ± 0.0015 Å |
| b | 10.9389 ± 0.0011 Å |
| c | 32.773 ± 0.003 Å |
| α | 90° |
| β | 91.177 ± 0.002° |
| γ | 90° |
| Cell volume | 5158.6 ± 0.9 Å3 |
| Cell temperature | 180 ± 2 K |
| Ambient diffraction temperature | 180 ± 2 K |
| Number of distinct elements | 7 |
| 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 | 0.1456 |
| Residual factor for significantly intense reflections | 0.0707 |
| Weighted residual factors for significantly intense reflections | 0.1375 |
| Weighted residual factors for all reflections included in the refinement | 0.1633 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.026 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 301830 (current) | 2025-08-20 | Add cross-references to PubChem compounds in COD range 4/07/ Each referenced PubChem compound corresponds to the full crystal structure. |
4072445.cif |
| 178613 | 2016-03-21 | cif/4/07/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/07/24. |
4072445.cif |
| 120075 | 2014-07-11 | Adding DOIs to range 4/07 structures. | 4072445.cif |
| 47256 | 2012-03-23 | cif/4/ Distributing the new range 4 CIFs into their appropriate prefixed subdirectories. |
4072445.cif |
| 45148 | 2012-03-20 | ../uploads/cif-deposit/cod/cif Adding structures of 4072442, 4072443, 4072444, 4072445, 4072446 via cif-deposit CGI script. |
4072445.cif |
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Users of the data should acknowledge the original authors of the
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