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Information card for entry 4076426
Preview
Coordinates | 4076426.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C74 H78 F3 Ir O10.5 P4 Ru S |
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Calculated formula | C60 H50 F3 Ir O7 P4 Ru S |
Title of publication | Geminal Carbon‒Hydrogen Bond Activation in Cumulenes Promoted by Adjacent Iridium/Ruthenium Centers |
Authors of publication | MacDougall, Tiffany J.; Samant, Rahul G.; Trepanier, Steven J.; Ferguson, Michael J.; McDonald, Robert; Cowie, Martin |
Journal of publication | Organometallics |
Year of publication | 2012 |
Journal volume | 31 |
Journal issue | 5 |
Pages of publication | 1857 |
a | 18.5564 ± 0.0013 Å |
b | 15.2146 ± 0.001 Å |
c | 24.4022 ± 0.0016 Å |
α | 90° |
β | 90° |
γ | 90° |
Cell volume | 6889.4 ± 0.8 Å3 |
Cell temperature | 173 ± 2 K |
Ambient diffraction temperature | 173 ± 2 K |
Number of distinct elements | 8 |
Space group number | 62 |
Hermann-Mauguin space group symbol | P n m a |
Hall space group symbol | -P 2ac 2n |
Residual factor for all reflections | 0.0664 |
Residual factor for significantly intense reflections | 0.0608 |
Weighted residual factors for significantly intense reflections | 0.1354 |
Weighted residual factors for all reflections included in the refinement | 0.1379 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.131 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | Yes |
Has Fobs | No |
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The link is: https://www.crystallography.net/4076426.html
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