Information card for entry 4088131

Structure parameters

• Formula: C108 H96 B6 F24 N30 O12 Ru6
• Calculated formula: C108 H96 B6 F24 N30 O12 Ru6
• Title of publication: Oxidative Route to Abnormal NHC Compounds from Singly Bonded [M‒M] (M = Ru, Rh, Pd) Precursors
• Authors of publication: Saha, Sayantani; Daw, Prosenjit; Bera, Jitendra K.
• Journal of publication: Organometallics
• Year of publication: 2015
• Journal volume: 34
• Journal issue: 23
• Pages of publication: 5509
• a: 19.236 ± 0.004 Å
• b: 19.236 ± 0.004 Å
• c: 33.377 ± 0.007 Å
• α: 90°
• β: 90°
• γ: 120°
• Cell volume: 10696 ± 4 ų
• Cell temperature: 273 ± 2 K
• Ambient diffraction temperature: 273 ± 2 K
• Number of distinct elements: 7
• Space group number: 148
• Hermann-Mauguin space group symbol: R -3 :H
• Hall space group symbol: -R 3
• Residual factor for all reflections: 0.1162
• Residual factor for significantly intense reflections: 0.0854
• Weighted residual factors for significantly intense reflections: 0.2288
• Weighted residual factors for all reflections included in the refinement: 0.2517
• Goodness-of-fit parameter for all reflections included in the refinement: 1.067
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No