Information card for entry 7119494

Structure parameters

• Chemical name: 16.PF6
• Formula: C32 H32 F6 N8 O4 P Re S
• Calculated formula: C32 H32 F6 N8 O4 P Re S
• Title of publication: Rhenium(i) complexes of N-heterocyclic carbene ligands that bind to amyloid plaques of Alzheimer's disease.
• Authors of publication: Chan, Chung Ying; Noor, Asif; McLean, Catriona A.; Donnelly, Paul S.; Barnard, Peter J.
• Journal of publication: Chemical communications (Cambridge, England)
• Year of publication: 2017
• Journal volume: 53
• Journal issue: 15
• Pages of publication: 2311 - 2314
• a: 8.7659 ± 0.0003 Å
• b: 12.9987 ± 0.0007 Å
• c: 16.3263 ± 0.0011 Å
• α: 68.155 ± 0.006°
• β: 76.597 ± 0.004°
• γ: 81.414 ± 0.004°
• Cell volume: 1675.6 ± 0.17 ų
• Cell temperature: 150 K
• Ambient diffraction temperature: 150 K
• Number of distinct elements: 8
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0302
• Residual factor for significantly intense reflections: 0.0264
• Weighted residual factors for significantly intense reflections: 0.0622
• Weighted residual factors for all reflections included in the refinement: 0.0645
• Goodness-of-fit parameter for all reflections included in the refinement: 1.044
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No