Information card for entry 7016938

Structure parameters

• Formula: C64.5 H85 Cl F6 I3 N8 O0 P Rh2
• Calculated formula: C58.5 H71 Cl F6 I3 N8 P Rh2
• Title of publication: Smooth C(alkyl)-H bond activation in rhodium complexes comprising abnormal carbene ligands.
• Authors of publication: Krüger, Anneke; Häller, L Jonas L; Müller-Bunz, Helge; Serada, Olha; Neels, Antonia; Macgregor, Stuart A.; Albrecht, Martin
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2011
• Journal volume: 40
• Journal issue: 38
• Pages of publication: 9911 - 9920
• a: 26.7628 ± 0.0017 Å
• b: 26.7351 ± 0.0018 Å
• c: 20.3079 ± 0.0011 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 14530.4 ± 1.6 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 2 K
• Number of distinct elements: 9
• Space group number: 52
• Hermann-Mauguin space group symbol: P n n a
• Hall space group symbol: -P 2a 2bc
• Residual factor for all reflections: 0.2121
• Residual factor for significantly intense reflections: 0.0827
• Weighted residual factors for significantly intense reflections: 0.1977
• Weighted residual factors for all reflections included in the refinement: 0.2425
• Goodness-of-fit parameter for all reflections included in the refinement: 0.837
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No