Information card for entry 4329675

Structure parameters

• Formula: C20 H20 Br F12 N5 O P2 Ru
• Calculated formula: C20 H20 Br F12 N5 O P2 Ru
• Title of publication: Structural Influence on the Photochromic Response of a Series of Ruthenium Mononitrosyl Complexes
• Authors of publication: Benoit Cormary; Sonia Ladeira; Kane Jacob; Pascal G. Lacroix; Theo Woike; Dominik Schaniel; Isabelle Malfant
• Journal of publication: Inorganic Chemistry
• Year of publication: 2012
• Journal volume: 51
• Pages of publication: 7492 - 7501
• a: 16.814 ± 0.005 Å
• b: 12.842 ± 0.005 Å
• c: 26.396 ± 0.005 Å
• α: 90 ± 0.005°
• β: 90 ± 0.005°
• γ: 90 ± 0.005°
• Cell volume: 5700 ± 3 ų
• Cell temperature: 180 ± 2 K
• Ambient diffraction temperature: 180 ± 2 K
• Number of distinct elements: 8
• Space group number: 61
• Hermann-Mauguin space group symbol: P b c a
• Hall space group symbol: -P 2ac 2ab
• Residual factor for all reflections: 0.0468
• Residual factor for significantly intense reflections: 0.0288
• Weighted residual factors for significantly intense reflections: 0.0612
• Weighted residual factors for all reflections included in the refinement: 0.0676
• Goodness-of-fit parameter for all reflections included in the refinement: 1.006
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No