Information card for entry 4309338

Structure parameters

• Formula: C46 H44 Cl2 N8 O2 Os2
• Calculated formula: C46 H36 Cl2 N8 O2 Os2
• SMILES: OC.c1cccc2[n]1[Os]134(Cl)N(c5ccccc5)c5[n]([Os]4(Cl)([n]4c(N3c3ccccc3)cccc4)(N(c3ccccc3)c3[n]1cccc3)N2c1ccccc1)cccc5.OC
• Title of publication: Diosmium(III) Compounds Supported by 2-Anilinopyridinate and Novel Alkynyl Derivatives
• Authors of publication: Yan-Hui Shi; Wei-Zhong Chen; Kevin D. John; Ryan E. Da Re; Joshua L. Cohn; Guo-Lin Xu; Judith L. Eglin; Alfred P. Sattelberger; Curtis R. Hare; Tong Ren
• Journal of publication: Inorganic Chemistry
• Year of publication: 2005
• Journal volume: 44
• Pages of publication: 5719 - 5727
• a: 14.8766 ± 0.0015 Å
• b: 16.2444 ± 0.0017 Å
• c: 17.6895 ± 0.0015 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 4274.9 ± 0.7 ų
• Cell temperature: 300 ± 2 K
• Ambient diffraction temperature: 300 ± 2 K
• Number of distinct elements: 6
• Space group number: 61
• Hermann-Mauguin space group symbol: P b c a
• Hall space group symbol: -P 2ac 2ab
• Residual factor for all reflections: 0.0426
• Residual factor for significantly intense reflections: 0.0271
• Weighted residual factors for significantly intense reflections: 0.0691
• Weighted residual factors for all reflections included in the refinement: 0.0763
• Goodness-of-fit parameter for all reflections included in the refinement: 1.011
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No