Information card for entry 4076083

Structure parameters

• Formula: C43 H58 N2 Na O P Ru Si2
• Calculated formula: C43 H58 N2 Na O P Ru Si2
• SMILES: [Ru]123456([P]7(C[Si]([N]1([Na]([O]1CCCC1)[N]2([Si](C7)(C)C)c1ccccc1)c1ccccc1)(C)C)c1ccccc1)[CH]1=[CH]3C4CC[CH]5=[CH]6C1.c1(ccccc1)C
• 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: 10.2121 ± 0.0004 Å
• b: 10.3162 ± 0.0003 Å
• c: 22.133 ± 0.001 Å
• α: 87.707 ± 0.007°
• β: 79.077 ± 0.006°
• γ: 64.334 ± 0.004°
• Cell volume: 2061.24 ± 0.16 ų
• Cell temperature: 173.2 K
• Ambient diffraction temperature: 173.2 K
• Number of distinct elements: 8
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.052
• Residual factor for significantly intense reflections: 0.029
• Weighted residual factors for all reflections: 0.0821
• Weighted residual factors for all reflections included in the refinement: 0.0821
• Goodness-of-fit parameter for all reflections: 1.484
• Goodness-of-fit parameter for all reflections included in the refinement: 1.485
• Diffraction radiation wavelength: 0.7107 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No