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Information card for entry 1556336
Preview
Coordinates | 1556336.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C135 H100 Cl6 F3 O3 P6 Rh3 S |
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Calculated formula | C135 H100 Cl6 F3 O3 P6 Rh3 S |
SMILES | C(F)(F)(S(=O)(=O)[O-])F.c12c3ccccc3ccc1[P](c1ccccc1)([Rh]1([Cl]3[Rh]4([Cl]1[Rh]13[P](c3ccccc3)(c3ccccc3)c3ccc5ccccc5c3c3c5ccccc5ccc3[P]1(c1ccccc1)c1ccccc1)[P](c1ccc3ccccc3c1c1c([P]4(c3ccccc3)c3ccccc3)ccc3c1cccc3)(c1ccccc1)c1ccccc1)[P](c1ccccc1)(c1ccccc1)c1ccc3ccccc3c21)c1ccccc1.C(Cl)Cl.C(Cl)Cl |
Title of publication | Halide bridged trinuclear rhodium complexes and their inhibiting influence on catalysis |
Authors of publication | Preetz, Angelika; Kohrt, Christina; Meißner, Antje; Wei, Siping; Drexler, Hans-Joachim; Buschmann, Helmut; Heller, Detlef |
Journal of publication | Catal. Sci. Technol. |
Year of publication | 2013 |
Journal volume | 3 |
Journal issue | 2 |
Pages of publication | 462 |
a | 16.493 ± 0.003 Å |
b | 23.276 ± 0.005 Å |
c | 16.775 ± 0.003 Å |
α | 90° |
β | 118.1 ± 0.03° |
γ | 90° |
Cell volume | 5681 ± 2 Å3 |
Cell temperature | 200 ± 2 K |
Ambient diffraction temperature | 200 ± 2 K |
Number of distinct elements | 8 |
Space group number | 4 |
Hermann-Mauguin space group symbol | P 1 21 1 |
Hall space group symbol | P 2yb |
Residual factor for all reflections | 0.1018 |
Residual factor for significantly intense reflections | 0.0424 |
Weighted residual factors for significantly intense reflections | 0.0617 |
Weighted residual factors for all reflections included in the refinement | 0.0745 |
Goodness-of-fit parameter for all reflections included in the refinement | 0.554 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | Yes |
Has Fobs | No |
Revision | Date | Message | Files |
---|---|---|---|
244217 (current) | 2019-11-28 | cif/ Adding structures of 1556333, 1556334, 1556335, 1556336, 1556337, 1556338, 1556339, 1556340 via cif-deposit CGI script. |
1556336.cif |
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Users of the data should acknowledge the original authors of the
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