Information card for entry 4076086

Structure parameters

• Formula: C44.5 H63 N2 P3 Ru Si4
• Calculated formula: C44.5 H63 N2 P3 Ru Si4
• SMILES: [Ru]1234([P]5(C[Si](N2[Si](C[P]1(C[Si]([NH]3[Si](C5)(C)C)(C)C)c1ccccc1)(C)C)(C)C)c1ccccc1)[P](c1c4cccc1)(c1ccccc1)c1ccccc1.C(CC)CC
• Title of publication: Intramolecular C−H and N−H Transfer by Ruthenium(II) Amidophosphine Complexes
• Authors of publication: Fryzuk, Michael D.; Petrella, Michael J.; Patrick, Brian O.
• Journal of publication: Organometallics
• Year of publication: 2005
• Journal volume: 24
• Journal issue: 22
• Pages of publication: 5440
• a: 20.3845 ± 0.0008 Å
• b: 21.7255 ± 0.0008 Å
• c: 43.1498 ± 0.0019 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 19109.5 ± 1.3 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 2 K
• Number of distinct elements: 6
• Space group number: 61
• Hermann-Mauguin space group symbol: P b c a
• Hall space group symbol: -P 2ac 2ab
• Residual factor for all reflections: 0.0831
• Residual factor for significantly intense reflections: 0.0642
• Weighted residual factors for significantly intense reflections: 0.1484
• Weighted residual factors for all reflections included in the refinement: 0.1581
• Goodness-of-fit parameter for all reflections included in the refinement: 1.1
• Diffraction radiation wavelength: 0.71069 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No