Information card for entry 4322960

Structure parameters

• Formula: C32 H54 Cl2 Cu2 N4 O17 S4
• Calculated formula: C32 H44 Cl2 Cu2 N4 O17.5 S4
• Title of publication: Helical Figure-of-Eight Loop Dicopper(I) Compounds: Syntheses, Structures, and Dynamics
• Authors of publication: Peter Comba; Andreas Fath; Trevor W. Hambley; Andreas Kühner; David T. Richens; Annette Vielfort
• Journal of publication: Inorganic Chemistry
• Year of publication: 1998
• Journal volume: 37
• Pages of publication: 4389 - 4401
• a: 12.582 ± 0.002 Å
• b: 21.997 ± 0.004 Å
• c: 7.772 ± 0.002 Å
• α: 91.45 ± 0.02°
• β: 93.87 ± 0.02°
• γ: 78.85 ± 0.01°
• Cell volume: 2105.4 ± 0.7 ų
• Cell temperature: 294.2 K
• Ambient diffraction temperature: 294.2 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 significantly intense reflections: 0.0619
• Weighted residual factors for significantly intense reflections: 0.0685
• Goodness-of-fit parameter for significantly intense reflections: 4.376
• Diffraction radiation wavelength: 1.5418 Å
• Diffraction radiation type: CuKalpha
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No