Information card for entry 7052414

Structure parameters

• Formula: C30 H54 O2 P2 Ru
• Calculated formula: C30 H54 O2 P2 Ru
• SMILES: [RuH2]1(Oc2ccccc2O1)([P](C(C)C)(C(C)C)C(C)C)[P](C(C)C)(C(C)C)C(C)C.c1ccccc1
• Title of publication: New d4 dihydrides of Ru(iv) and Os(iv) with ?-donor ligands: M(H)2(chelate)(PiPr3)2 with chelate =ortho-XYC6H4 with X, Y = O, NR; R = H or CH3
• Authors of publication: Ferrando-Miguel, German; Wu, Peng; Huffman, John C.; Caulton, Kenneth G.
• Journal of publication: New Journal of Chemistry
• Year of publication: 2005
• Journal volume: 29
• Journal issue: 1
• Pages of publication: 193
• a: 11.224 ± 0.002 Å
• b: 11.907 ± 0.002 Å
• c: 12.51 ± 0.002 Å
• α: 77.529 ± 0.005°
• β: 89.453 ± 0.005°
• γ: 76.548 ± 0.005°
• Cell volume: 1586.2 ± 0.5 ų
• Cell temperature: 153 ± 2 K
• Ambient diffraction temperature: 153 ± 2 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for significantly intense reflections: 0.0351
• Weighted residual factors for all reflections included in the refinement: 0.0346
• Goodness-of-fit parameter for all reflections included in the refinement: 1.033
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No