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Information card for entry 7717733
Preview
| Coordinates | 7717733.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Common name | [((hexadiene)Pt)2Ttftt](BArF4)2 |
|---|---|
| Chemical name | (μ-1,1',3,3'-tetrathiafulvalene-4,4',5,5'-tetrathiolato cation)-bis(hexa-1,5-diene)-di-platinum(ii) tetrakis[3,5-bis(trifluoromethyl)phenyl]borate dichloromethane solvate |
| Formula | C83 H46 B2 Cl2 F48 Pt2 S8 |
| Calculated formula | C83 H46 B2 Cl2 F48 Pt2 S8 |
| Title of publication | Deconvoluting capping ligand influence on photophysical properties in tetrathiafulvalene-based diradicaloids. |
| Authors of publication | Lopez, Nathan E.; McNamara, Lauren E.; Anferov, Sophie W.; Anderson, John S. |
| Journal of publication | Dalton transactions (Cambridge, England : 2003) |
| Year of publication | 2025 |
| Journal volume | 54 |
| Journal issue | 3 |
| Pages of publication | 908 - 914 |
| a | 12.7858 ± 0.0005 Å |
| b | 19.3482 ± 0.0006 Å |
| c | 20.0914 ± 0.0006 Å |
| α | 81.874 ± 0.003° |
| β | 71.534 ± 0.003° |
| γ | 78.323 ± 0.003° |
| Cell volume | 4600.8 ± 0.3 Å3 |
| Cell temperature | 99.9 ± 0.6 K |
| Ambient diffraction temperature | 99.9 ± 0.6 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 | 0.1973 |
| Residual factor for significantly intense reflections | 0.1632 |
| Weighted residual factors for significantly intense reflections | 0.3507 |
| Weighted residual factors for all reflections included in the refinement | 0.3697 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.108 |
| Diffraction radiation probe | x-ray |
| Diffraction radiation wavelength | 1.54184 Å |
| Diffraction radiation type | CuKα |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 298945 (current) | 2025-04-05 | cif/ Updating files of 7717733, 7717734, 7717735, 7717736, 7717737, 7717738 Original log message: Adding full bibliography for 7717733--7717738.cif. |
7717733.cif |
| 297011 | 2025-01-01 | cif/ Adding structures of 7717733, 7717734, 7717735, 7717736, 7717737, 7717738 via cif-deposit CGI script. |
7717733.cif |
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Users of the data should acknowledge the original authors of the
structural data.