Information card for entry 4076085

Structure parameters

• Formula: C32 H43 N2 P Ru Si2
• Calculated formula: C32 H43 N2 P Ru Si2
• SMILES: [Ru]12345([P](C[Si](N1c1ccccc1)(C)C)(C[Si](Nc1ccccc1)(C)C)c1ccccc1)[CH]1=[CH]2CC[CH]3=[CH]4C5C1
• 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: 42.2752 ± 0.0007 Å
• b: 42.2752 ± 0.0007 Å
• c: 9.0004 ± 0.0003 Å
• α: 90°
• β: 90°
• γ: 120°
• Cell volume: 13930.4 ± 0.6 ų
• Cell temperature: 173.2 K
• Ambient diffraction temperature: 173.2 K
• Number of distinct elements: 6
• Space group number: 148
• Hermann-Mauguin space group symbol: R -3 :H
• Hall space group symbol: -R 3
• Residual factor for all reflections: 0.0502
• Residual factor for significantly intense reflections: 0.028
• Weighted residual factors for all reflections: 0.0759
• Weighted residual factors for all reflections included in the refinement: 0.0759
• Goodness-of-fit parameter for all reflections: 0.875
• Goodness-of-fit parameter for all reflections included in the refinement: 0.875
• Diffraction radiation wavelength: 0.7107 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No