Information card for entry 7709246

Structure parameters

• Formula: C54 H45 F6 N4 O3 P3 Ru S
• Calculated formula: C54 H45 F6 N4 O3 P3 Ru S
• Title of publication: Ruthenium(II)-diphosphine complexes containing acylthiourea ligands are effective against lung and breast cancers.
• Authors of publication: Grawe, Gregory F.; Oliveira, Katia M.; Leite, Celisnolia M.; de Oliveira, Tamires D.; Honorato, João; Ferreira, Antonio G.; Castellano, Eduardo E.; Cominetti, Marcia R.; Correa, Rodrigo S.; Batista, Alzir A.
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2022
• Journal volume: 51
• Journal issue: 4
• Pages of publication: 1489 - 1501
• a: 19.3556 ± 0.0004 Å
• b: 22.3068 ± 0.0004 Å
• c: 23.0775 ± 0.0004 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 9964 ± 0.3 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 8
• Space group number: 60
• Hermann-Mauguin space group symbol: P b c n
• Hall space group symbol: -P 2n 2ab
• Residual factor for all reflections: 0.0796
• Residual factor for significantly intense reflections: 0.05
• Weighted residual factors for significantly intense reflections: 0.0961
• Weighted residual factors for all reflections included in the refinement: 0.1252
• Goodness-of-fit parameter for all reflections included in the refinement: 1.288
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No