Information card for entry 4086147

Structure parameters

• Formula: C64 H100 Ge2 O2.5 P2 Ru
• Calculated formula: C64 H100 Ge2 O2.5 P2 Ru
• Title of publication: A Ruthenium Dihydrogen Germylene Complex and the Catalytic Synthesis of Digermoxane
• Authors of publication: Smart, Katharine A.; Mothes-Martin, Emmanuelle; Vendier, Laure; Perutz, Robin N.; Grellier, Mary; Sabo-Etienne, Sylviane
• Journal of publication: Organometallics
• Year of publication: 2015
• Journal volume: 34
• Journal issue: 16
• Pages of publication: 4158
• a: 11.731 ± 0.0002 Å
• b: 12.259 ± 0.0003 Å
• c: 21.654 ± 0.0003 Å
• α: 90°
• β: 101.101 ± 0.001°
• γ: 90°
• Cell volume: 3055.8 ± 0.1 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 6
• Space group number: 7
• Hermann-Mauguin space group symbol: P 1 n 1
• Hall space group symbol: P -2yac
• Residual factor for all reflections: 0.0337
• Residual factor for significantly intense reflections: 0.0289
• Weighted residual factors for significantly intense reflections: 0.0644
• Weighted residual factors for all reflections included in the refinement: 0.0667
• Goodness-of-fit parameter for all reflections included in the refinement: 1.038
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No