Information card for entry 4074043

Structure parameters

• Formula: C27 H40 K2 O2 P2
• Calculated formula: C27 H40 K2 O2 P2
• Title of publication: Mono-, Di-, and Trinuclear Complexes Featuring the New Bis(phosphido) Ligand 4,5-Bis(tert-butylphosphido)-9,9-dimethylxanthene ([POP]2−)
• Authors of publication: Turculet, Laura; McDonald, Robert
• Journal of publication: Organometallics
• Year of publication: 2007
• Journal volume: 26
• Journal issue: 27
• Pages of publication: 6821
• a: 12.5425 ± 0.0013 Å
• b: 22.708 ± 0.002 Å
• c: 11.3647 ± 0.0012 Å
• α: 90°
• β: 113.609 ± 0.0015°
• γ: 90°
• Cell volume: 2965.9 ± 0.5 ų
• Cell temperature: 193 ± 2 K
• Ambient diffraction temperature: 193 ± 2 K
• Number of distinct elements: 5
• 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: 0.1076
• Residual factor for significantly intense reflections: 0.0557
• Weighted residual factors for significantly intense reflections: 0.1285
• Weighted residual factors for all reflections included in the refinement: 0.1511
• Goodness-of-fit parameter for all reflections included in the refinement: 1.022
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No