Information card for entry 2213117

Structure parameters

• Chemical name: Bis(2-benzyliminomethyl-5-methylphenyl-κ^2^C^1^,N)dicarbonylruthenium(II)
• Formula: C32 H28 N2 O2 Ru
• Calculated formula: C32 H28 N2 O2 Ru
• SMILES: [Ru]12([N](=Cc3c1cc(C)cc3)Cc1ccccc1)([N](=Cc1ccc(C)cc21)Cc1ccccc1)(C#[O])C#[O]
• Title of publication: Bis(2-benzyliminomethyl-5-methylphenyl-κ^2^<i>C</i>^1^,<i>N</i>)dicarbonylruthenium(II)
• Authors of publication: Ma, Jing; Xu, Jing; Su, Wei-Ping
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2007
• Journal volume: 63
• Journal issue: 5
• Pages of publication: m1421 - m1421
• a: 9.685 ± 0.003 Å
• b: 16.813 ± 0.004 Å
• c: 17.126 ± 0.004 Å
• α: 90°
• β: 99.156 ± 0.005°
• γ: 90°
• Cell volume: 2753.2 ± 1.3 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 5
• 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: 0.0425
• Residual factor for significantly intense reflections: 0.0346
• Weighted residual factors for significantly intense reflections: 0.0788
• Weighted residual factors for all reflections included in the refinement: 0.0838
• Goodness-of-fit parameter for all reflections included in the refinement: 1.088
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes