Information card for entry 4318795

Structure parameters

• Formula: C27 H36 B9 P2 Rh
• Calculated formula: C27 H36 B9 P2 Rh
• SMILES: [Rh]12345([P](C[P]([BH]([H]5)[H]3)(c3ccccc3)c3ccccc3)(c3ccccc3)c3ccccc3)[BH]356[BH]789[BH]%10%11%12[BH]%1337[CH]%12([BH]37%11[BH]%119%10[BH]158[BH]23%11[H]7)[CH]46%13
• Title of publication: Phosphine-Boranes as Bidentate Ligands: Formation of [8,8-η2-{η2-(BH3).dppm}-nido-8,7-RhSB9H10] and [9,9-η2-{η2-(BH3).dppm}-nido-9,7,8-RhC2B8H11] from [8,8-(η2-dppm)-8-(η1-dppm)-nido-8,7-RhSB9H10] and [9,9-(η2-dppm)-9-(η1-dppm)-nido-9,7,8-RhC2B8H11], Respectively
• Authors of publication: Oleg Volkov; Ramón Macías; Nigam P. Rath; Lawrence Barton
• Journal of publication: Inorganic Chemistry
• Year of publication: 2002
• Journal volume: 41
• Pages of publication: 5837 - 5843
• a: 10.8504 ± 0.0009 Å
• b: 16.1632 ± 0.0014 Å
• c: 18.1727 ± 0.0015 Å
• α: 91.269 ± 0.006°
• β: 91.546 ± 0.006°
• γ: 106.672 ± 0.006°
• Cell volume: 3050.5 ± 0.5 ų
• Cell temperature: 140 ± 2 K
• Ambient diffraction temperature: 140 ± 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 all reflections: 0.1281
• Residual factor for significantly intense reflections: 0.0633
• Weighted residual factors for significantly intense reflections: 0.1461
• Weighted residual factors for all reflections included in the refinement: 0.1736
• Goodness-of-fit parameter for all reflections included in the refinement: 1.051
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No