Information card for entry 7711686

Structure parameters

• Formula: C26 H28 Cl F6 Fe N2 P Ru
• Calculated formula: C26 H28 Cl F6 Fe N2 P Ru
• Title of publication: A Ru(ii)-arene-ferrocene complex with promising antibacterial activity
• Authors of publication: Mensah, Stephen; Rosenthal, Joseph D.; Dagar, Mamta; Brown, Tyson; Mills, Jonathan J.; Hamaker, Christopher G.; Ferrence, Gregory M.; Webb, Michael I.
• Journal of publication: Dalton Transactions
• Year of publication: 2022
• a: 18.6 ± 0.002 Å
• b: 20.872 ± 0.002 Å
• c: 13.7091 ± 0.0012 Å
• α: 90°
• β: 88.123 ± 0.007°
• γ: 90°
• Cell volume: 5319.3 ± 0.9 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 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: 0.0417
• Residual factor for significantly intense reflections: 0.0306
• Weighted residual factors for significantly intense reflections: 0.0773
• Weighted residual factors for all reflections included in the refinement: 0.0844
• Goodness-of-fit parameter for all reflections included in the refinement: 1.079
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No