Information card for entry 7004923

Structure parameters

• Formula: C60 H55 Cl2 F6 O3 P5 Pd
• Calculated formula: C60 H55 Cl2 F6 O3 P5 Pd
• Title of publication: Five-coordinate Pd(II) orthometallated triarylphosphite complexes.
• Authors of publication: Bedford, Robin B.; Betham, Michael; Butts, Craig P.; Coles, Simon J.; Cutajar, Marica; Gelbrich, Thomas; Hursthouse, Michael B.; Scully, P. Noelle; Wimperis, Stephen
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2007
• Journal issue: 4
• Pages of publication: 459 - 466
• a: 10.294 ± 0.002 Å
• b: 15.29 ± 0.003 Å
• c: 18.798 ± 0.005 Å
• α: 105.391 ± 0.015°
• β: 93.38 ± 0.02°
• γ: 94.9 ± 0.02°
• Cell volume: 2831.9 ± 1.1 ų
• Cell temperature: 120 ± 2 K
• Ambient diffraction temperature: 120 ± 2 K
• Number of distinct elements: 7
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0606
• Residual factor for significantly intense reflections: 0.0462
• Weighted residual factors for significantly intense reflections: 0.1113
• Weighted residual factors for all reflections included in the refinement: 0.1191
• Goodness-of-fit parameter for all reflections included in the refinement: 1.046
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No