Information card for entry 7037844

Structure parameters

• Formula: C43 H50 N2 O P2 Ru Si
• Calculated formula: C43 H50 N2 O P2 Ru Si
• SMILES: [RuH]1([P](N2C=CN(C=12)C)(C(C)(C)C)C(C)(C)C)([P](c1ccccc1)(c1ccccc1)c1ccccc1)([SiH](c1ccccc1)c1ccccc1)C#[O]
• Title of publication: Preparation and reactivity of a Ru(0) phosphino-carbene complex.
• Authors of publication: Mosaferi, Eliar; Pan, Li; Wang, Tongen; Sun, Yunshan; Pranckevicius, Conor; Stephan, Douglas W.
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2016
• Journal volume: 45
• Journal issue: 4
• Pages of publication: 1354 - 1358
• a: 14.81 ± 0.0008 Å
• b: 17.607 ± 0.001 Å
• c: 16.9584 ± 0.0009 Å
• α: 90°
• β: 106.458 ± 0.003°
• γ: 90°
• Cell volume: 4240.9 ± 0.4 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150.01 K
• Number of distinct elements: 7
• 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: 0.0718
• Residual factor for significantly intense reflections: 0.0413
• Weighted residual factors for significantly intense reflections: 0.0792
• Weighted residual factors for all reflections included in the refinement: 0.0861
• Goodness-of-fit parameter for all reflections included in the refinement: 0.97
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No