Information card for entry 7711687

Structure parameters

• Common name: Webb/SM-105 [(cymene)RuCl(NN)][PF6].acetone
• Formula: C25 H30 Cl F6 N2 O P Ru
• Calculated formula: C25 H30 Cl F6 N2 O 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: 9.1814 ± 0.0008 Å
• b: 12.3291 ± 0.0011 Å
• c: 12.6542 ± 0.0012 Å
• α: 76.919 ± 0.005°
• β: 73.108 ± 0.005°
• γ: 87.998 ± 0.005°
• Cell volume: 1334.3 ± 0.2 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 8
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0234
• Residual factor for significantly intense reflections: 0.0199
• Weighted residual factors for significantly intense reflections: 0.0466
• Weighted residual factors for all reflections included in the refinement: 0.0482
• Goodness-of-fit parameter for all reflections included in the refinement: 1.035
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No