Information card for entry 7102886

Structure parameters

• Formula: C76.5 H61 Cl5 Cu F6 N2 P3
• Calculated formula: C76.5 H61 Cl5 Cu F6 N2 P3
• Title of publication: Stereoselective coordination of ditopic phospholyl-azahelicenes: a novel approach towards structural diversity in chiral pi-conjugated assemblies.
• Authors of publication: Shen, Wenting; Graule, Sébastien; Crassous, Jeanne; Lescop, Christophe; Gornitzka, Heinz; Réau, Régis
• Journal of publication: Chemical communications (Cambridge, England)
• Year of publication: 2008
• Journal issue: 7
• Pages of publication: 850 - 852
• a: 14.431 ± 0.002 Å
• b: 21.614 ± 0.003 Å
• c: 22.007 ± 0.003 Å
• α: 82.315 ± 0.004°
• β: 85.456 ± 0.005°
• γ: 75.858 ± 0.004°
• Cell volume: 6588.7 ± 1.6 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 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: 0.1628
• Residual factor for significantly intense reflections: 0.0793
• Weighted residual factors for significantly intense reflections: 0.1887
• Weighted residual factors for all reflections included in the refinement: 0.2282
• Goodness-of-fit parameter for all reflections included in the refinement: 1.028
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No