Information card for entry 4110273

Structure parameters

• Common name: 05060x
• Formula: C100 H48 B2 F48 N6 Ru
• Calculated formula: C100 H48 B2 F48 N6 Ru
• Title of publication: Porous Crystalline Ruthenium Complexes Are Oxygen Sensors
• Authors of publication: Kari A. McGee; David J. Veltkamp; Brian J. Marquardt; Kent R. Mann
• Journal of publication: Journal of the American Chemical Society
• Year of publication: 2007
• Journal volume: 129
• Pages of publication: 15092 - 15093
• a: 30.846 ± 0.002 Å
• b: 14.903 ± 0.001 Å
• c: 24.201 ± 0.0016 Å
• α: 90°
• β: 119.436 ± 0.001°
• γ: 90°
• Cell volume: 9689 ± 1.1 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 6
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Residual factor for all reflections: 0.0567
• Residual factor for significantly intense reflections: 0.0469
• Weighted residual factors for significantly intense reflections: 0.1198
• Weighted residual factors for all reflections included in the refinement: 0.129
• Goodness-of-fit parameter for all reflections included in the refinement: 1.028
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No