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Information card for entry 1552034
Preview
Coordinates | 1552034.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C67 H65 Cl6 F6 O6 P3 Rh2 S2 Si2 |
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Calculated formula | C63 F3 O3 P3 Rh2 S Si2 |
SMILES | [Rh]1234[Rh]567([P](C[P]2(c2ccccc2)c2ccccc2)(c2ccccc2)c2ccccc2)(OS(=O)(=O)C(F)(F)F)[C]([Si](C)(C)C)#[C]5[C]23c3ccccc3C([P]1(c1ccccc1)c1ccccc1)c1ccccc1[C]4=2[C]6#[C]7[Si](C)(C)C |
Title of publication | Low-valent Homobimetallic Rh Complexes: Influence of Ligands on the Structure and the Intramolecular Reactivity of Rh‒H Intermediates |
Authors of publication | Jurt, Pascal; Salnikov, Oleg; Gianetti, Thomas L.; Chukanov, Nikita; Baker, Matthew G.; Le Corre, Grégoire; Borger, Jaap E.; Verel, René; Gauthier, Sébastien; Fuhr, Olaf; Kovtunov, Kirill V.; Fedorov, Alexey; Fenske, Dieter; Koptyug, Igor V.; Grützmacher, Hansjörg |
Journal of publication | Chemical Science |
Year of publication | 2019 |
a | 18.6773 ± 0.0005 Å |
b | 20.3524 ± 0.0004 Å |
c | 21.3813 ± 0.0005 Å |
α | 90° |
β | 115.129 ± 0.002° |
γ | 90° |
Cell volume | 7358.4 ± 0.3 Å3 |
Cell temperature | 153.15 K |
Ambient diffraction temperature | 153.15 K |
Number of distinct elements | 9 |
Space group number | 14 |
Hermann-Mauguin space group symbol | P 1 21/c 1 |
Hall space group symbol | -P 2ybc |
Residual factor for all reflections | 0.0899 |
Residual factor for significantly intense reflections | 0.0652 |
Weighted residual factors for significantly intense reflections | 0.1713 |
Weighted residual factors for all reflections included in the refinement | 0.1845 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.038 |
Diffraction radiation probe | x-ray |
Diffraction radiation wavelength | 1.54186 Å |
Diffraction radiation type | CuKα |
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/1552034.html
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