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Information card for entry 7010199
Preview
Coordinates | 7010199.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C18 H8 O12 Ru4 |
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Calculated formula | C18 H8 O12 Ru4 |
SMILES | [Ru]123([Ru]456([Ru]78([Ru]915(C8=O)(C#[O])(C#[O])[C]4([C]36C)=[C]79CC)(C#[O])(C#[O])C#[O])(C2=O)(C#[O])C#[O])(C#[O])(C#[O])C#[O] |
Title of publication | Novel coordination modes of partially hydrogenated diyne ligands on metal carbonyl clusters † |
Authors of publication | Clarke, Lionel P.; Davies, John E.; Raithby, Paul R.; Shields, Gregory P. |
Journal of publication | Journal of the Chemical Society, Dalton Transactions |
Year of publication | 2000 |
Journal issue | 24 |
Pages of publication | 4527 |
a | 11.02 ± 0.004 Å |
b | 21.034 ± 0.007 Å |
c | 10.018 ± 0.012 Å |
α | 90° |
β | 90° |
γ | 90° |
Cell volume | 2322 ± 3 Å3 |
Cell temperature | 150 ± 2 K |
Ambient diffraction temperature | 150 ± 2 K |
Number of distinct elements | 4 |
Space group number | 19 |
Hermann-Mauguin space group symbol | P 21 21 21 |
Hall space group symbol | P 2ac 2ab |
Residual factor for all reflections | 0.1043 |
Residual factor for significantly intense reflections | 0.0631 |
Weighted residual factors for all reflections | 0.1285 |
Weighted residual factors for significantly intense reflections | 0.1122 |
Goodness-of-fit parameter for all reflections | 1.01 |
Goodness-of-fit parameter for significantly intense reflections | 1.054 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
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