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Information card for entry 4072082
Preview
Coordinates | 4072082.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C41 H25 Ag Cl2 N2 O20 Os6 |
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Calculated formula | C41 H25 Ag Cl2 N2 O20 Os6 |
SMILES | c1n(cc[n+]1c1c(cc(cc1C)C)C)c1c(cc(cc1C)C)C.[Cl]1[Os]23(C#[O])([Ag]4([Os]56([Cl][Os]45(C#[O])(C#[O])(C#[O])[Os]6(C#[O])(C#[O])(C#[O])C#[O])(C#[O])(C#[O])C#[O])[Os]12(C#[O])(C#[O])(C#[O])[Os]3(C#[O])(C#[O])(C#[O])C#[O])(C#[O])C#[O] |
Title of publication | NHC Complexes of Osmium Clusters: A Structural and Reactivity Study |
Authors of publication | Cooke, Craig E.; Jennings, Michael C.; Katz, Michael J.; Pomeroy, R. K.; Clyburne, Jason A. C. |
Journal of publication | Organometallics |
Year of publication | 2008 |
Journal volume | 27 |
Journal issue | 22 |
Pages of publication | 5777 |
a | 14.5755 ± 0.0008 Å |
b | 21.6908 ± 0.0016 Å |
c | 17.6188 ± 0.0011 Å |
α | 90° |
β | 106.714 ± 0.003° |
γ | 90° |
Cell volume | 5334.9 ± 0.6 Å3 |
Cell temperature | 296 ± 2 K |
Ambient diffraction temperature | 296 ± 2 K |
Number of distinct elements | 7 |
Space group number | 15 |
Hermann-Mauguin space group symbol | C 1 2/c 1 |
Hall space group symbol | -C 2yc |
Residual factor for all reflections | 0.1404 |
Residual factor for significantly intense reflections | 0.0737 |
Weighted residual factors for significantly intense reflections | 0.1721 |
Weighted residual factors for all reflections included in the refinement | 0.2044 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.01 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
For the version history of this entry, please navigate to main COD server.
The link is: https://www.crystallography.net/4072082.html
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Users of the data should acknowledge the original authors of the
structural data.