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Information card for entry 4344225
Preview
| Coordinates | 4344225.cif |
|---|---|
| Original paper (by DOI) | HTML |
| External links | PubChem |
| Formula | C132 H112 F12 O12 P8 Pd4 S8 |
|---|---|
| Calculated formula | C132 H112 F12 O12 P8 Pd4 S8 |
| Title of publication | Supramolecular Macrocyclic Pd(II) and Pt(II) Squares and Rectangles with Aryldithiolate Ligands and their Excellent Catalytic Activity in Suzuki C-C Coupling Reaction. |
| Authors of publication | Vivekananda, K. V.; Dey, S.; Maity, D. K.; Bhuvanesh, N.; Jain, V. K. |
| Journal of publication | Inorganic chemistry |
| Year of publication | 2015 |
| Journal volume | 54 |
| Journal issue | 21 |
| Pages of publication | 10153 - 10162 |
| a | 14.619 ± 0.003 Å |
| b | 14.797 ± 0.003 Å |
| c | 18.15 ± 0.003 Å |
| α | 92.291 ± 0.002° |
| β | 113.233 ± 0.002° |
| γ | 91.287 ± 0.002° |
| Cell volume | 3601.8 ± 1.2 Å3 |
| Cell temperature | 110.15 K |
| Ambient diffraction temperature | 110.15 K |
| Number of distinct elements | 7 |
| Space group number | 2 |
| Hermann-Mauguin space group symbol | P -1 |
| Hall space group symbol | -P 1 |
| Residual factor for all reflections | 0.0579 |
| Residual factor for significantly intense reflections | 0.0466 |
| Weighted residual factors for significantly intense reflections | 0.1257 |
| Weighted residual factors for all reflections included in the refinement | 0.1359 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.027 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 301840 (current) | 2025-08-21 | Add cross-references to PubChem compounds in COD range 4/34/ Each referenced PubChem compound corresponds to the full crystal structure. |
4344225.cif |
| 170056 | 2015-11-06 | cif/ Updating files of 4344224, 4344225, 4344226 Original log message: Adding full bibliography for 4344224--4344226.cif. |
4344225.cif |
| 161100 | 2015-10-09 | cif/ Adding structures of 4344224, 4344225, 4344226 via cif-deposit CGI script. |
4344225.cif |
All data in the COD and the database itself are dedicated to the
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Users of the data should acknowledge the original authors of the
structural data.