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Information card for entry 7038152
Preview
Coordinates | 7038152.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C44 H60 F3 O3 P2 Rh S Si |
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Calculated formula | C44 H60 F3 O3 P2 Rh S Si |
SMILES | [Rh]12345([P](c6c([Si]2(OS(=O)(=O)C(F)(F)F)c2ccccc2[P]1(C1CCCCC1)C1CCCCC1)cccc6)(C1CCCCC1)C1CCCCC1)[CH]1=[CH]3C2CC1[CH]4=[CH]52 |
Title of publication | Examining the role of Rh/Si cooperation in alkene hydrogenation by a pincer-type [P2Si]Rh complex. |
Authors of publication | Whited, Matthew T.; Deetz, Alexander M.; Donnell, Theodore M.; Janzen, Daron E. |
Journal of publication | Dalton transactions (Cambridge, England : 2003) |
Year of publication | 2016 |
Journal volume | 45 |
Journal issue | 24 |
Pages of publication | 9758 - 9761 |
a | 11.5434 ± 0.0005 Å |
b | 17.6337 ± 0.0007 Å |
c | 20.4488 ± 0.0008 Å |
α | 90° |
β | 90° |
γ | 90° |
Cell volume | 4162.4 ± 0.3 Å3 |
Cell temperature | 100 ± 2 K |
Ambient diffraction temperature | 100 ± 2 K |
Number of distinct elements | 8 |
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 | 0.0519 |
Residual factor for significantly intense reflections | 0.0384 |
Weighted residual factors for significantly intense reflections | 0.069 |
Weighted residual factors for all reflections included in the refinement | 0.0724 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.066 |
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/7038152.html
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