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Information card for entry 4338506
Preview
| Coordinates | 4338506.cif |
|---|---|
| Original paper (by DOI) | HTML |
| External links | PubChem |
| Formula | C82 H76 N9 Nd O10 P6 S2 |
|---|---|
| Calculated formula | C82 H76 N9 Nd O10 P6 S2 |
| Title of publication | Lanthanide(III) complexes with 4,5-bis(diphenylphosphinoyl)-1,2,3-triazolate and the use of 1,10-phenanthroline as auxiliary ligand. |
| Authors of publication | Correa-Ascencio, Marisol; Galván-Miranda, Elizabeth K; Rascón-Cruz, Fernando; Jiménez-Sandoval, Omar; Jiménez-Sandoval, Sergio J; Cea-Olivares, Raymundo; Jancik, Vojtech; Toscano, R. Alfredo; García-Montalvo, Verónica |
| Journal of publication | Inorganic chemistry |
| Year of publication | 2010 |
| Journal volume | 49 |
| Journal issue | 9 |
| Pages of publication | 4109 - 4116 |
| a | 12.23 ± 0.005 Å |
| b | 21.105 ± 0.008 Å |
| c | 16.403 ± 0.006 Å |
| α | 90° |
| β | 107.81 ± 0.02° |
| γ | 90° |
| Cell volume | 4031 ± 3 Å3 |
| Cell temperature | 294 ± 2 K |
| Ambient diffraction temperature | 294 ± 2 K |
| Number of distinct elements | 7 |
| Space group number | 4 |
| Hermann-Mauguin space group symbol | P 1 21 1 |
| Hall space group symbol | P 2yb |
| Residual factor for all reflections | 0.0952 |
| Residual factor for significantly intense reflections | 0.065 |
| Weighted residual factors for significantly intense reflections | 0.109 |
| Weighted residual factors for all reflections included in the refinement | 0.1206 |
| Goodness-of-fit parameter for all reflections included in the refinement | 0.992 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 301839 (current) | 2025-08-21 | Add cross-references to PubChem compounds in COD range 4/33/ Each referenced PubChem compound corresponds to the full crystal structure. |
4338506.cif |
| 179488 | 2016-03-23 | cif/4/33/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/33/85. |
4338506.cif |
| 114485 | 2014-05-24 | cif/ Adding structures of 4338504, 4338505, 4338506, 4338507, 4338508 via cif-deposit CGI script. |
4338506.cif |
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Users of the data should acknowledge the original authors of the
structural data.