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Information card for entry 1551514
Preview
Coordinates | 1551514.cif |
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Original paper (by DOI) | HTML |
Formula | C129.4 H116.8 Cl10.8 N8 O10 P4 Rh2 |
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Calculated formula | C129.4 H116.8 Cl10.8 N8 O10 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 | 12.8064 ± 0.0002 Å |
b | 15.7601 ± 0.0003 Å |
c | 17.3674 ± 0.0002 Å |
α | 70.329 ± 0.001° |
β | 75.142 ± 0.001° |
γ | 70.305 ± 0.001° |
Cell volume | 3066.93 ± 0.09 Å3 |
Cell temperature | 150 ± 2 K |
Ambient diffraction temperature | 150 ± 2 K |
Number of distinct elements | 7 |
Space group number | 2 |
Hermann-Mauguin space group symbol | P -1 |
Hall space group symbol | -P 1 |
Residual factor for all reflections | 0.0717 |
Residual factor for significantly intense reflections | 0.0529 |
Weighted residual factors for significantly intense reflections | 0.1329 |
Weighted residual factors for all reflections included in the refinement | 0.1457 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.025 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | Yes |
Has Fobs | No |
Revision | Date | Message | Files |
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216121 (current) | 2019-06-20 | cif/ Adding structures of 1551514, 1551515 via cif-deposit CGI script. |
1551514.cif |
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Users of the data should acknowledge the original authors of the
structural data.