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Information card for entry 4122789
Preview
Coordinates | 4122789.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C36 H34 F3 N2 O2 Rh |
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Calculated formula | C36 H34 F3 N2 O2 Rh |
Title of publication | Long-Range C-H Bond Activation by Rh(III)-Carboxylates. |
Authors of publication | O'Reilly, Matthew E; Fu, Ross; Nielsen, Robert J.; Sabat, Michal; Goddard, 3rd, William A; Gunnoe, T. Brent |
Journal of publication | Journal of the American Chemical Society |
Year of publication | 2014 |
Journal volume | 136 |
Journal issue | 42 |
Pages of publication | 14690 - 14693 |
a | 10.4419 ± 0.0019 Å |
b | 11.239 ± 0.002 Å |
c | 13.655 ± 0.003 Å |
α | 84.562 ± 0.004° |
β | 85.982 ± 0.003° |
γ | 75.605 ± 0.003° |
Cell volume | 1543.4 ± 0.5 Å3 |
Cell temperature | 233 ± 2 K |
Ambient diffraction temperature | 233 ± 2 K |
Number of distinct elements | 6 |
Space group number | 2 |
Hermann-Mauguin space group symbol | P -1 |
Hall space group symbol | -P 1 |
Residual factor for all reflections | 0.0278 |
Residual factor for significantly intense reflections | 0.0229 |
Weighted residual factors for significantly intense reflections | 0.0482 |
Weighted residual factors for all reflections included in the refinement | 0.05 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.04 |
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/4122789.html
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