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Information card for entry 4073271
Preview
Coordinates | 4073271.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C52 H40 Fe O10 P2 Ru4 |
---|---|
Calculated formula | C52 H40 Fe O10 P2 Ru4 |
SMILES | [Ru]12345([Ru]678([Ru]1([Ru]26(C#[O])(C#[O])(C#[O])([H]5)[H]8)(C#[O])(C#[O])(C#[O])[H]7)([P](c1c(cccc1)[c]12[Fe]56789%10%11([c]1([cH]5[cH]6[cH]27)[C@H]([P]3(c1ccccc1)c1ccccc1)C)[cH]1[cH]%11[cH]%10[cH]9[cH]81)(c1ccccc1)c1ccccc1)(C#[O])(C#[O])[H]4)(C#[O])C#[O] |
Title of publication | Unprecedented Enantioselectivity in a Cluster-Based Catalytic System |
Authors of publication | Moberg, Viktor; Haukka, Matti; Koshevoy, Igor O.; Ortiz, Roberto; Nordlander, Ebbe |
Journal of publication | Organometallics |
Year of publication | 2007 |
Journal volume | 26 |
Journal issue | 17 |
Pages of publication | 4090 |
a | 10.836 ± 0.002 Å |
b | 14.243 ± 0.003 Å |
c | 32.129 ± 0.006 Å |
α | 90° |
β | 90° |
γ | 90° |
Cell volume | 4958.7 ± 1.7 Å3 |
Cell temperature | 120 ± 2 K |
Ambient diffraction temperature | 120 ± 2 K |
Number of distinct elements | 6 |
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 | 0.0852 |
Residual factor for significantly intense reflections | 0.0702 |
Weighted residual factors for significantly intense reflections | 0.1768 |
Weighted residual factors for all reflections included in the refinement | 0.183 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.123 |
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/4073271.html
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Users of the data should acknowledge the original authors of the
structural data.