Information card for entry 7040059

Structure parameters

• Formula: C73.09 H84.19 Au F6 N6 O0.77 P3
• Calculated formula: C73.092 H84.184 Au F6 N6 O0.773 P3
• Title of publication: Mono- and dimeric complexes of an asymmetric heterotopic P,CNHC,pyr ligand.
• Authors of publication: Bouché, Mathilde; Mordan, Michael; Kariuki, Benson M.; Coles, Simon J.; Christensen, Jeppe; Newman, Paul D.
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2016
• Journal volume: 45
• Journal issue: 34
• Pages of publication: 13347 - 13360
• a: 10.5073 ± 0.0004 Å
• b: 12.4401 ± 0.0005 Å
• c: 14.0349 ± 0.0006 Å
• α: 73.907 ± 0.004°
• β: 71.633 ± 0.004°
• γ: 87.024 ± 0.003°
• Cell volume: 1671.58 ± 0.13 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 2 K
• Number of distinct elements: 7
• Space group number: 1
• Hermann-Mauguin space group symbol: P 1
• Hall space group symbol: P 1
• Residual factor for all reflections: 0.0419
• Residual factor for significantly intense reflections: 0.0412
• Weighted residual factors for significantly intense reflections: 0.091
• Weighted residual factors for all reflections included in the refinement: 0.0923
• Goodness-of-fit parameter for all reflections included in the refinement: 1.026
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No