Information card for entry 7004373

Structure parameters

• Common name: (cyclopentadienyl)(diisopropylphenylphosphine)(dimethylchloros ilyl) ruthenium dihydride
• Chemical name: (cyclopentadienyl)(diisopropylphenylphosphine)(dimethylchlorosilyl) ruthenium dihydride
• Formula: C19 H32 Cl P Ru Si
• Calculated formula: C19 H32 Cl P Ru Si
• SMILES: [RuH2]1234([P](c5ccccc5)(C(C)C)C(C)C)([Si](Cl)(C)C)[cH]5[cH]1[cH]2[cH]3[cH]45
• Title of publication: Unexpected effect of the ring on the extent of Si⋯H interligand interactions in half-sandwich silyl hydrides of ruthenium
• Authors of publication: Gutsulyak, Dmitry V.; Osipov, Alexandr L.; Kuzmina, Lyudmila G.; Howard, Judith A. K.; Nikonov, Georgii I.
• Journal of publication: Dalton Transactions
• Year of publication: 2008
• Journal issue: 47
• Pages of publication: 6843 - 6850
• a: 8.7462 ± 0.0001 Å
• b: 16.4554 ± 0.0003 Å
• c: 29.3627 ± 0.0005 Å
• α: 90°
• β: 92.351 ± 0.001°
• γ: 90°
• Cell volume: 4222.39 ± 0.12 ų
• Cell temperature: 123 ± 2 K
• Ambient diffraction temperature: 123 ± 2 K
• Number of distinct elements: 6
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.0653
• Residual factor for significantly intense reflections: 0.0383
• Weighted residual factors for significantly intense reflections: 0.0795
• Weighted residual factors for all reflections included in the refinement: 0.0857
• Goodness-of-fit parameter for all reflections included in the refinement: 1.022
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No