Information card for entry 7034812

Structure parameters

• Formula: C18 H52 P6 Rh2
• Calculated formula: C18 H52 P6 Rh2
• SMILES: C1[P](C)(C)[Rh](C[P](C)(C)[Rh]1([P](C)(C)C)[P](C)(C)C)([P](C)(C)C)[P](C)(C)C
• Title of publication: Selective B-B bond activation in an unsymmetrical diborane(4) by [(Me3P)4Rh-X] (X = Me, OtBu): a switch of mechanism?
• Authors of publication: Borner, C.; Brandhorst, K.; Kleeberg, C.
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2015
• Journal volume: 44
• Journal issue: 18
• Pages of publication: 8600 - 8604
• a: 9.6621 ± 0.0002 Å
• b: 12.0824 ± 0.0002 Å
• c: 13.1972 ± 0.0002 Å
• α: 90°
• β: 108.536 ± 0.002°
• γ: 90°
• Cell volume: 1460.74 ± 0.05 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 4
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.0214
• Residual factor for significantly intense reflections: 0.02
• Weighted residual factors for significantly intense reflections: 0.0466
• Weighted residual factors for all reflections included in the refinement: 0.0473
• Goodness-of-fit parameter for all reflections included in the refinement: 1.069
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No