Information card for entry 4075745

Structure parameters

• Formula: C30 H38 N2 Ru2
• Calculated formula: C30 H38 N2 Ru2
• SMILES: [Ru]12345(Nc6c(N1)c[c]17[Ru]89%10%11%12%13%14%15([cH]1[cH]8[cH]9[cH]%10[c]7%11c6)[c]1([c]%12([c]%13([c]%14([c]%151C)C)C)C)C)[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: 9.7682 ± 0.0008 Å
• b: 11.4013 ± 0.0007 Å
• c: 12.4389 ± 0.0012 Å
• α: 76.597 ± 0.005°
• β: 86.581 ± 0.003°
• γ: 85.825 ± 0.003°
• Cell volume: 1342.71 ± 0.19 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 2 K
• Number of distinct elements: 4
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0473
• Residual factor for significantly intense reflections: 0.036
• Weighted residual factors for significantly intense reflections: 0.0941
• Weighted residual factors for all reflections included in the refinement: 0.0993
• Goodness-of-fit parameter for all reflections included in the refinement: 1.047
• Diffraction radiation wavelength: 0.71075 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No