Information card for entry 4077599

Structure parameters

• Chemical name: (mu-hapto4-pentahydrodiboranyl)(mu-dimethylphosphido) bis(pentamethylcyclopentadienylruthenium)
• Formula: C22 H41 B2 P Ru2
• Calculated formula: C22 H41 B2 P Ru2
• SMILES: [Ru]12345678([Ru]9%10%11%12%13%14([P]1(C)C)([c]1([c]%10([c]%11([c]%12([c]%131C)C)C)C)C)[H][BH]169([BH]7%14[H]1)[H]8)[c]1([c]2([c]3([c]4([c]51C)C)C)C)C
• Title of publication: Syntheses and Structures of New Diruthenatetraborane Complexes Exhibiting Novel Modes of Coordination for a B2H5Fragment: Phosphine-Complexed [(Cp*Ru)2(μ-H)(∥-μ-η4-B2H5)(PR3)] (PR3= PMe3, PMe2Ph) and Phosphido-Bridgednido-[(Cp*Ru)2(μ-PMe2)(⊥-μ-η4-B2H5)]1
• Authors of publication: Pangan, Lourdes N.; Kawano, Yasuro; Shimoi, Mamoru
• Journal of publication: Organometallics
• Year of publication: 2000
• Journal volume: 19
• Journal issue: 26
• Pages of publication: 5575
• a: 18.854 ± 0.002 Å
• b: 15.238 ± 0.003 Å
• c: 17.855 ± 0.003 Å
• α: 90°
• β: 101.265 ± 0.014°
• γ: 90°
• Cell volume: 5030.9 ± 1.4 ų
• Cell temperature: 268 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 5
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Residual factor for all reflections: 0.0531
• Residual factor for significantly intense reflections: 0.0518
• Weighted residual factors for all reflections: 0.1666
• Weighted residual factors for significantly intense reflections: 0.1628
• Goodness-of-fit parameter for all reflections: 0.237
• Goodness-of-fit parameter for significantly intense reflections: 0.233
• Diffraction radiation wavelength: 0.71069 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No