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Information card for entry 4104147
Preview
Coordinates | 4104147.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C48 H51 B F4 N2 O P2 Ru |
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Calculated formula | C48 H51 B F4 N2 O P2 Ru |
Title of publication | Activation of an Alkyl C-H Bond Geminal to an Agostic Interaction: An Unusual Mode of Base-Induced C-H Activation |
Authors of publication | L. Jonas L. Häller; Michael J. Page; Stuart A. Macgregor; Mary F. Mahon; Michael K. Whittlesey |
Journal of publication | Journal of the American Chemical Society |
Year of publication | 2009 |
Journal volume | 131 |
Pages of publication | 4604 - 4605 |
a | 13.512 ± 0.0002 Å |
b | 22.591 ± 0.0003 Å |
c | 14.469 ± 0.0002 Å |
α | 90° |
β | 92.453 ± 0.001° |
γ | 90° |
Cell volume | 4412.61 ± 0.11 Å3 |
Cell temperature | 150 ± 2 K |
Ambient diffraction temperature | 150 ± 2 K |
Number of distinct elements | 8 |
Space group number | 14 |
Hermann-Mauguin space group symbol | P 1 21/n 1 |
Hall space group symbol | -P 2yn |
Residual factor for all reflections | 0.1118 |
Residual factor for significantly intense reflections | 0.0777 |
Weighted residual factors for significantly intense reflections | 0.1426 |
Weighted residual factors for all reflections included in the refinement | 0.1537 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.212 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | Yes |
Has Fobs | No |
For the version history of this entry, please navigate to main COD server.
The link is: https://www.crystallography.net/4104147.html
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