Information card for entry 7705854

Structure parameters

• Formula: C68 H79 B F24 N P2 Rh
• Calculated formula: C68 H79 B F24 N P2 Rh
• Title of publication: Reactions of Rh(PNP) pincer complexes with terminal alkynes: homocoupling through a ring or not at all.
• Authors of publication: Hood, Thomas M.; Chaplin, Adrian B.
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2020
• Journal volume: 49
• Journal issue: 46
• Pages of publication: 16649 - 16652
• a: 17.9713 ± 0.0004 Å
• b: 15.8991 ± 0.0003 Å
• c: 25.1382 ± 0.0005 Å
• α: 90°
• β: 92.814 ± 0.002°
• γ: 90°
• Cell volume: 7174 ± 0.3 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 2 K
• Number of distinct elements: 7
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.0844
• Residual factor for significantly intense reflections: 0.0689
• Weighted residual factors for significantly intense reflections: 0.1888
• Weighted residual factors for all reflections included in the refinement: 0.1968
• Goodness-of-fit parameter for all reflections included in the refinement: 1.059
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 1.54184 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No