Information card for entry 4075746

Structure parameters

• Formula: C30 H38 N2 Ru2
• Calculated formula: C30 H38 N2 Ru2
• SMILES: [Ru]12345(N[C]67=[C]8([Ru]9%10%11%12%13%14%156([CH]7=[C]6%10C=CC=C[C]%116=[CH]89)[c]6([c]%12([c]%13([c]%14([c]%156C)C)C)C)C)N1)[c]1([c]2([c]3([c]4([c]51C)C)C)C)C
• Title of publication: Dinuclear Ruthenium(II) κ2-Diamido/η6-Naphthalene Complexes Featuring a Coordinatively Unsaturated yet Highly π-Basic (η5-C5Me5)Ru Diamide Fragment
• Authors of publication: Takemoto, Shin; Oshio, Shinya; Shiromoto, Takayuki; Matsuzaka, Hiroyuki
• Journal of publication: Organometallics
• Year of publication: 2005
• Journal volume: 24
• Journal issue: 5
• Pages of publication: 801
• a: 14.492 ± 0.006 Å
• b: 15.164 ± 0.006 Å
• c: 24.876 ± 0.008 Å
• α: 90°
• β: 92.62 ± 0.03°
• γ: 90°
• Cell volume: 5461 ± 4 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 2 K
• Number of distinct elements: 4
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.1243
• Residual factor for significantly intense reflections: 0.0782
• Weighted residual factors for significantly intense reflections: 0.1781
• Weighted residual factors for all reflections included in the refinement: 0.1972
• Goodness-of-fit parameter for all reflections included in the refinement: 1.142
• Diffraction radiation wavelength: 0.71075 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No