Information card for entry 7001118

Structure parameters

• Common name: Tris(mu!2$-methoxido)-bis(hapto$6!-p-cymene)-di-osmium(ii) hexafluorophosphate
• Chemical name: Tris(mu~2~-methoxido)-bis(hapto^6^-p-cymene)- di-osmium(II) hexafluorophosphate
• Formula: C23 H37 F6 O3 Os2 P
• Calculated formula: C23 H37 F6 O3 Os2 P
• SMILES: [Os]1234567([O](C)[Os]89%10%11%12([O]1C)([O]2C)[c]1([cH]9[cH]%10[c]%11([cH]%12[cH]81)C(C)C)C)[c]1([cH]4[cH]5[c]6([cH]7[cH]31)C(C)C)C.[P](F)(F)(F)(F)(F)[F-]
• Title of publication: Synthesis, X-ray diffraction structure, spectroscopic properties and antiproliferative activity of a novel ruthenium complex with constitutional similarity to cisplatin
• Authors of publication: Grguric-Sipka, Sanja; Stepanenko, Iryna N.; Lazic, Jelena M.; Bartel, Caroline; Jakupec, Michael A.; Arion, Vladimir B.; Keppler, Bernhard K.
• Journal of publication: Dalton Transactions
• Year of publication: 2009
• Journal issue: 17
• Pages of publication: 3334 - 3339
• a: 11.2483 ± 0.0003 Å
• b: 13.6694 ± 0.0004 Å
• c: 34.263 ± 0.0009 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 5268.2 ± 0.3 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 6
• Space group number: 19
• Hermann-Mauguin space group symbol: P 21 21 21
• Hall space group symbol: P 2ac 2ab
• Residual factor for all reflections: 0.0251
• Residual factor for significantly intense reflections: 0.0228
• Weighted residual factors for significantly intense reflections: 0.0483
• Weighted residual factors for all reflections included in the refinement: 0.0489
• Goodness-of-fit parameter for all reflections included in the refinement: 0.993
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No