Information card for entry 7107229

Structure parameters

• Formula: C26 H45 Cl N P2 Rh Si
• Calculated formula: C26 H45 Cl N P2 Rh Si
• SMILES: [RhH]1(Cl)([P](c2c([Si]1(C)c1c(N(C)C)cccc1)cccc2)(C(C)(C)C)C(C)(C)C)[P](C)(C)C
• Title of publication: 'Hemilabile' silyl pincer ligation: platinum group PSiN complexes and triple C-H activation to form a (PSiC)Ru carbene complex
• Authors of publication: Adam J. Ruddy; Samuel Mitton; Robert McDonald; Laura Turculet
• Journal of publication: Chem.Commun.
• Year of publication: 2012
• Journal volume: 48
• Pages of publication: 1159
• a: 8.5401 ± 0.0006 Å
• b: 9.8992 ± 0.0007 Å
• c: 18.8502 ± 0.0013 Å
• α: 93.9595 ± 0.0007°
• β: 100.299 ± 0.0007°
• γ: 106.656 ± 0.0007°
• Cell volume: 1489.85 ± 0.18 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 2 K
• Number of distinct elements: 7
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0218
• Residual factor for significantly intense reflections: 0.0204
• Weighted residual factors for significantly intense reflections: 0.0542
• Weighted residual factors for all reflections included in the refinement: 0.0553
• Goodness-of-fit parameter for all reflections included in the refinement: 1.057
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No