Information card for entry 4505115

Structure parameters

• Common name: silver tris(2-pyridylmethyl)cyclotriguaiacylene hexafluorophosphine
• Formula: C42 H39 Ag1.5 F9 N3 O6 P1.5
• Calculated formula: C42 H39 Ag1.5 F9.03 N3 O6 P1.5
• Title of publication: Disentangling Disorder in the Three-Dimensional Coordination Network of {Ag3[Tris(2-pyridylmethyl)cyclotriguaiacylene]2}(PF6)3
• Authors of publication: Sumby, Christopher J.; Hardie, Michaele J.
• Journal of publication: Crystal Growth & Design
• Year of publication: 2005
• Journal volume: 5
• Journal issue: 4
• Pages of publication: 1321
• a: 35.8 ± 0.004 Å
• b: 35.8 ± 0.004 Å
• c: 35.8 ± 0.004 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 45883 ± 9 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 2 K
• Number of distinct elements: 7
• Space group number: 219
• Hermann-Mauguin space group symbol: F -4 3 c
• Hall space group symbol: F -4a 2 3
• Residual factor for all reflections: 0.2193
• Residual factor for significantly intense reflections: 0.1574
• Weighted residual factors for significantly intense reflections: 0.3641
• Weighted residual factors for all reflections included in the refinement: 0.4178
• Goodness-of-fit parameter for all reflections included in the refinement: 2.748
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No