Information card for entry 7703318

Structure parameters

• Chemical name: [(1-(1H-κN2-indazol-1-yl)-3-methyl-4-oxo-1,4-dihydronaphtalene-1,2-bis(olato)-κO1-κO2))(η6-p-cymene)ruthenium(II)]
• Formula: C28.7 H27.75 N2 O3.17 Ru
• Calculated formula: C28.7 H27.75 N2 O3.175 Ru
• Title of publication: Novel phthiocol-based organometallics with tridentate coordination motif and their unexpected cytotoxic behaviour.
• Authors of publication: Geisler, Heiko; Wernitznig, Debora; Hejl, Michaela; Gajic, Natalie; Jakupec, Michael A.; Kandioller, Wolfgang; Keppler, Bernhard K.
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2020
• Journal volume: 49
• Journal issue: 5
• Pages of publication: 1393 - 1397
• a: 11.441 ± 0.0002 Å
• b: 15.6073 ± 0.0003 Å
• c: 17.4184 ± 0.0003 Å
• α: 107.783 ± 0.0007°
• β: 99.4 ± 0.0007°
• γ: 108.573 ± 0.0006°
• Cell volume: 2687.88 ± 0.09 ų
• Cell temperature: 100 K
• Ambient diffraction temperature: 100 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0651
• Residual factor for significantly intense reflections: 0.0455
• Weighted residual factors for significantly intense reflections: 0.0934
• Weighted residual factors for all reflections included in the refinement: 0.1049
• Goodness-of-fit parameter for all reflections included in the refinement: 1.039
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No