Information card for entry 7040060

Structure parameters

• Formula: C43 H53 Cl F6 N3 O2 P2 Pt
• Calculated formula: C43 H53 Cl F6 N3 O2 P2 Pt
• 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: 21.4948 ± 0.0003 Å
• b: 21.4948 ± 0.0003 Å
• c: 19.2489 ± 0.0005 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 8893.5 ± 0.3 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 8
• Space group number: 79
• Hermann-Mauguin space group symbol: I 4
• Hall space group symbol: I 4
• Residual factor for all reflections: 0.048
• Residual factor for significantly intense reflections: 0.0303
• Weighted residual factors for significantly intense reflections: 0.0561
• Weighted residual factors for all reflections included in the refinement: 0.0634
• Goodness-of-fit parameter for all reflections included in the refinement: 1.047
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No