Information card for entry 7060499

Structure parameters

• Formula: C6.67 H16.67 Cl2 F1.33 N5.33 O10.67 Ru1.33
• Calculated formula: C6.66667 H16.6667 Cl2 F1.33333 N5.33333 O10.6667 Ru1.33333
• Title of publication: Nitrosyl linkage photoisomerization in heteroleptic fluoride ruthenium complexes derived from labile nitrate precursors
• Authors of publication: Mikhailov, Artem A.; Komarov, Vladislav Yu.; Pishchur, Denis P.; Schaniel, Dominik; Kostin, Gennadiy A.
• Journal of publication: New Journal of Chemistry
• Year of publication: 2021
• Journal volume: 45
• Journal issue: 18
• Pages of publication: 8192 - 8202
• a: 18.6327 ± 0.0008 Å
• b: 13.8821 ± 0.0005 Å
• c: 10.4352 ± 0.0005 Å
• α: 90°
• β: 96.73 ± 0.004°
• γ: 90°
• Cell volume: 2680.6 ± 0.2 ų
• Cell temperature: 100 K
• Ambient diffraction temperature: 100 K
• Number of distinct elements: 7
• 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: 0.0701
• Residual factor for significantly intense reflections: 0.0395
• Weighted residual factors for significantly intense reflections: 0.0758
• Weighted residual factors for all reflections included in the refinement: 0.0924
• Goodness-of-fit parameter for all reflections included in the refinement: 1.071
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No