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Information card for entry 1551515
Preview
| Coordinates | 1551515.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C126 H112 B2 Cl12 F8 N8 O6 P4 Rh2 |
|---|---|
| Calculated formula | C126 H112 B2 Cl12 F8 N8 O6 P4 Rh2 |
| Title of publication | Effector responsive hydroformylation catalysis |
| Authors of publication | Bai, Shaotao; Sinha, Vivek; Kluwer, Sander; Linnebank, Pim; Dydio, Pawel; Lutz, Martin; Abiri, Zohar; de Bruin, Bas; Reek, Joost N. H. |
| Journal of publication | Chemical Science |
| Year of publication | 2019 |
| a | 12.7098 ± 0.0003 Å |
| b | 15.9386 ± 0.0004 Å |
| c | 17.4664 ± 0.0006 Å |
| α | 70.142 ± 0.001° |
| β | 74.739 ± 0.001° |
| γ | 69.74 ± 0.001° |
| Cell volume | 3079.2 ± 0.15 Å3 |
| Cell temperature | 150 ± 2 K |
| Ambient diffraction temperature | 150 ± 2 K |
| Number of distinct elements | 9 |
| Space group number | 2 |
| Hermann-Mauguin space group symbol | P -1 |
| Hall space group symbol | -P 1 |
| Residual factor for all reflections | 0.044 |
| Residual factor for significantly intense reflections | 0.0373 |
| Weighted residual factors for significantly intense reflections | 0.1026 |
| Weighted residual factors for all reflections included in the refinement | 0.1073 |
| 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 | Yes |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 216121 (current) | 2019-06-20 | cif/ Adding structures of 1551514, 1551515 via cif-deposit CGI script. |
1551515.cif |
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Users of the data should acknowledge the original authors of the
structural data.