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Information card for entry 7053353
Preview
Coordinates | 7053353.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C35 H19 N O12 Os3 P Re S |
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Calculated formula | C35 H19 N O12 Os3 P Re S |
SMILES | [Os]1([Os]23([Os]41([Re]2([n]1c([S]34)cccc1)(C#[O])(C#[O])C#[O])(C#[O])(C#[O])C#[O])(C#[O])(C#[O])C#[O])([P](c1ccccc1)(c1ccccc1)c1ccccc1)(C#[O])(C#[O])C#[O] |
Title of publication | The rational synthesis of tetranuclear heterometallic butterfly clusters: reactions of [M2(CO)6(μ-pyS)2] (M = Re, Mn) with group VIII metal carbonyls |
Authors of publication | Ghosh, Shishir; Khanam, Kamrun N.; Hossain, G. M. Golzar; Haworth, Daniel T.; Lindeman, Sergey V.; Hogarth, Graeme; Kabir, Shariff E. |
Journal of publication | New Journal of Chemistry |
Year of publication | 2010 |
Journal volume | 34 |
Journal issue | 9 |
Pages of publication | 1875 |
a | 13.1359 ± 0.0013 Å |
b | 15.1378 ± 0.0015 Å |
c | 18.6633 ± 0.0019 Å |
α | 90° |
β | 98.3 ± 0.001° |
γ | 90° |
Cell volume | 3672.3 ± 0.6 Å3 |
Cell temperature | 100 ± 2 K |
Ambient diffraction temperature | 100 ± 2 K |
Number of distinct elements | 8 |
Space group number | 14 |
Hermann-Mauguin space group symbol | P 1 21/c 1 |
Hall space group symbol | -P 2ybc |
Residual factor for all reflections | 0.0246 |
Residual factor for significantly intense reflections | 0.0195 |
Weighted residual factors for significantly intense reflections | 0.043 |
Weighted residual factors for all reflections included in the refinement | 0.0443 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.013 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
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