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Information card for entry 4514173
Preview
| Coordinates | 4514173.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C55.5 H71 O10.5 Rh2 |
|---|---|
| Calculated formula | C55.5 H71 O10.5 Rh2 |
| Title of publication | A Binaphthyl-Based Scaffold for a Chiral Dirhodium(II) Biscarboxylate Ligand with α-Quaternary Carbon Centers |
| Authors of publication | Chen, Po-An; Setthakarn, Krit; May, Jeremy A. |
| Journal of publication | ACS Catalysis |
| Year of publication | 2017 |
| Journal volume | 7 |
| Journal issue | 9 |
| Pages of publication | 6155 |
| a | 16.2948 ± 0.0006 Å |
| b | 17.0253 ± 0.0007 Å |
| c | 20.361 ± 0.0008 Å |
| α | 90° |
| β | 103.07 ± 0.001° |
| γ | 90° |
| Cell volume | 5502.3 ± 0.4 Å3 |
| Cell temperature | 173 ± 2 K |
| Ambient diffraction temperature | 173 ± 2 K |
| Number of distinct elements | 4 |
| 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 | 0.0271 |
| Residual factor for significantly intense reflections | 0.0259 |
| Weighted residual factors for significantly intense reflections | 0.0648 |
| Weighted residual factors for all reflections included in the refinement | 0.0655 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.061 |
| Diffraction radiation wavelength | 1.54178 Å |
| Diffraction radiation type | CuKα |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 200147 (current) | 2017-09-04 | cif/ Adding structures of 4514173 via cif-deposit CGI script. |
4514173.cif |
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