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Information card for entry 4304742
Preview
| Coordinates | 4304742.cif |
|---|---|
| Original paper (by DOI) | HTML |
| External links | PubChem |
| Formula | C20 H30 N8 Pt |
|---|---|
| Calculated formula | C20 H30 N8 Pt |
| SMILES | c1(cc(C)n(n1)[Pt](n1c(cc(C)n1)C)([n]1c(C)cc([nH]1)C)[n]1c(cc(C)[nH]1)C)C |
| Title of publication | Heteropolynuclear Complexes of 3,5-Dimethylpyrazolate [Pt2M4(Me2pz)8] (M = Ag, Cu). Highly Luminescent Character of the Triplet Excited State Based on Mixed-Metal Cores |
| Authors of publication | Keisuke Umakoshi; Takashi Kojima; Keizo Saito; Seiji Akatsu; Masayoshi Onishi; Shoji Ishizaka; Noboru Kitamura; Yoshihide Nakao; Shigeyoshi Sakaki; Yoshiki Ozawa |
| Journal of publication | Inorganic Chemistry |
| Year of publication | 2008 |
| Journal volume | 47 |
| Pages of publication | 5033 - 5035 |
| a | 17.285 ± 0.001 Å |
| b | 15.753 ± 0.002 Å |
| c | 17.4782 ± 0.0003 Å |
| α | 90° |
| β | 100.38 ± 0.0004° |
| γ | 90° |
| Cell volume | 4681.3 ± 0.7 Å3 |
| Cell temperature | 296.2 K |
| Number of distinct elements | 4 |
| Space group number | 15 |
| Hermann-Mauguin space group symbol | C 1 2/c 1 |
| Hall space group symbol | -C 2yc |
| Residual factor for significantly intense reflections | 0.0255 |
| Weighted residual factors for all reflections included in the refinement | 0.0694 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.014 |
| Diffraction radiation wavelength | 0.7107 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 301836 (current) | 2025-08-20 | Add cross-references to PubChem compounds in COD range 4/30/ Each referenced PubChem compound corresponds to the full crystal structure. |
4304742.cif |
| 271475 | 2021-12-16 | cif/4: Fixing some Z values and formulae |
4304742.cif |
| 176467 | 2016-02-16 | cif/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in range 4. |
4304742.cif |
| 120081 | 2014-07-12 | Adding DOIs to range 4/30 structures. | 4304742.cif |
| 34330 | 2012-02-24 | cif/4/ Reorganising CIF range 4 into a prefix tree. |
4304742.cif |
| 1163 | 2010-05-11 | cif/4/: committing data from the Inorg-Chem-2008_01-12/ deposition. | 4304742.cif |
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Users of the data should acknowledge the original authors of the
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