Information card for entry 4329672

Structure parameters

• Formula: C20 H20 B2 Cl F8 N5 O1.5 Ru
• Calculated formula: C20 H20 B2 Cl F8 N5 O1.5 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: 13.7292 ± 0.0003 Å
• b: 13.3179 ± 0.0002 Å
• c: 18.8043 ± 0.0003 Å
• α: 90°
• β: 126.324 ± 0.001°
• γ: 90°
• Cell volume: 2770.13 ± 0.09 ų
• Cell temperature: 180 ± 2 K
• Ambient diffraction temperature: 180 ± 2 K
• Number of distinct elements: 8
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.1018
• Residual factor for significantly intense reflections: 0.0645
• Weighted residual factors for significantly intense reflections: 0.2009
• Weighted residual factors for all reflections included in the refinement: 0.2427
• Goodness-of-fit parameter for all reflections included in the refinement: 1.074
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No