Information card for entry 4322389

Structure parameters

• Formula: C21 H34 N2 O2 Ru Si2 Zr
• Calculated formula: C21 H24 N2 O2 Ru Si2 Zr
• SMILES: [Zr]12345([Ru]6789(C#[O])(C#[O])[cH]%10[cH]6[cH]7[cH]8[cH]9%10)(N([Si](C)(C)C)CCCN1[Si](C)(C)C)[cH]1[cH]2[cH]3[cH]4[cH]51
• Title of publication: Heterodi- and Heterotrinuclear Complexes Containing Highly Polar Metal-Metal Bonds
• Authors of publication: Lutz H. Gade; Stefan Friedrich; Dominique J. M. Trösch; Ian J. Scowen; Mary McPartlin
• Journal of publication: Inorganic Chemistry
• Year of publication: 1999
• Journal volume: 38
• Pages of publication: 5295 - 5307
• a: 10.477 ± 0.002 Å
• b: 26.883 ± 0.004 Å
• c: 9.996 ± 0.0012 Å
• α: 90°
• β: 113.113 ± 0.014°
• γ: 90°
• Cell volume: 2589.4 ± 0.7 ų
• Cell temperature: 298 ± 2 K
• Ambient diffraction temperature: 298 ± 2 K
• Number of distinct elements: 7
• 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: 0.0955
• Residual factor for significantly intense reflections: 0.0674
• Weighted residual factors for significantly intense reflections: 0.1699
• Weighted residual factors for all reflections included in the refinement: 0.1986
• Goodness-of-fit parameter for all reflections included in the refinement: 0.99
• Diffraction radiation wavelength: 1.54178 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No