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Information card for entry 4067451
Preview
Coordinates | 4067451.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C40 H32 O10 Os3 P2 S2 |
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Calculated formula | C40 H32 O10 Os3 P2 S2 |
SMILES | [Os]12([Os]([Os]1(C#[O])(C#[O])(C#[O])C#[O])([P](CCSCCSCC[P]2(c1ccccc1)c1ccccc1)(c1ccccc1)c1ccccc1)(C#[O])(C#[O])C#[O])(C#[O])(C#[O])C#[O] |
Title of publication | Synthesis, Characterization, and Novel Fluxional Mechanisms of Triosmium Clusters Containing the Highly Flexible Ligand Ph2PC2H4SC2H4SC2H4PPh2(PSSP) |
Authors of publication | Persson, Roger; Stchedroff, Marc J.; Uebersezig, Bettina; Gobetto, Roberto; Steed, Jonathan W.; Prince, Paul D.; Monari, Magda; Nordlander, Ebbe |
Journal of publication | Organometallics |
Year of publication | 2010 |
Journal volume | 29 |
Journal issue | 10 |
Pages of publication | 2223 |
a | 11.8958 ± 0.0005 Å |
b | 18.4288 ± 0.0007 Å |
c | 19.8714 ± 0.0008 Å |
α | 90° |
β | 100.883 ± 0.001° |
γ | 90° |
Cell volume | 4278 ± 0.3 Å3 |
Cell temperature | 293 ± 2 K |
Ambient diffraction temperature | 293 ± 2 K |
Number of distinct elements | 6 |
Space group number | 4 |
Hermann-Mauguin space group symbol | P 1 21 1 |
Hall space group symbol | P 2yb |
Residual factor for all reflections | 0.0954 |
Residual factor for significantly intense reflections | 0.0422 |
Weighted residual factors for significantly intense reflections | 0.067 |
Weighted residual factors for all reflections included in the refinement | 0.0754 |
Goodness-of-fit parameter for all reflections included in the refinement | 0.72 |
Diffraction radiation wavelength | 0.71069 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
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The link is: https://www.crystallography.net/4067451.html
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Users of the data should acknowledge the original authors of the
structural data.