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Information card for entry 4069680
Preview
Coordinates | 4069680.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C49 H47 B O Ru |
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Calculated formula | C49 H47 B O Ru |
SMILES | O(CC)[c]12[c]34[Ru]56789%10%111([c]1([cH]5[cH]6[c]7([cH]8[cH]91)C)C(C)C)[c]12[c]%10(cccc1)[c]4%11cccc3.[B-](c1ccccc1)(c1ccccc1)(c1ccccc1)c1ccccc1 |
Title of publication | Preparation of (η5-Alkoxyfluorenyl)(η6-p-Cymene)-Sandwich Ruthenium(II) Complexes |
Authors of publication | Albertin, Gabriele; Antoniutti, Stefano; Callegaro, Fabio; Castro, Jesús |
Journal of publication | Organometallics |
Year of publication | 2009 |
Journal volume | 28 |
Journal issue | 15 |
Pages of publication | 4475 - 4479 |
a | 12.0598 ± 0.0005 Å |
b | 14.7273 ± 0.0008 Å |
c | 21.7163 ± 0.0011 Å |
α | 82.678 ± 0.003° |
β | 80.261 ± 0.002° |
γ | 88.684 ± 0.003° |
Cell volume | 3770.4 ± 0.3 Å3 |
Cell temperature | 296 ± 2 K |
Ambient diffraction temperature | 296 ± 2 K |
Number of distinct elements | 5 |
Space group number | 2 |
Hermann-Mauguin space group symbol | P -1 |
Hall space group symbol | -P 1 |
Residual factor for all reflections | 0.0982 |
Residual factor for significantly intense reflections | 0.0492 |
Weighted residual factors for significantly intense reflections | 0.0823 |
Weighted residual factors for all reflections included in the refinement | 0.0974 |
Goodness-of-fit parameter for all reflections included in the refinement | 0.989 |
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/4069680.html
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Users of the data should acknowledge the original authors of the
structural data.