Information card for entry 4319366

Structure parameters

• Formula: C13 H44 Cl4 Cu2 N6 O21
• Calculated formula: C13 H44 Cl4 Cu2 N6 O21
• Title of publication: Diverse Solid-State and Solution Structures within a Series of Hexaamine Dicopper(II) Complexes
• Authors of publication: Paul V. Bernhardt
• Journal of publication: Inorganic Chemistry
• Year of publication: 2001
• Journal volume: 40
• Pages of publication: 1086 - 1092
• a: 15.204 ± 0.005 Å
• b: 7.681 ± 0.0007 Å
• c: 29.37 ± 0.01 Å
• α: 90°
• β: 100.42 ± 0.02°
• γ: 90°
• Cell volume: 3373.3 ± 1.6 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 6
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/a 1
• Hall space group symbol: -P 2yab
• Residual factor for all reflections: 0.1302
• Residual factor for significantly intense reflections: 0.0668
• Weighted residual factors for significantly intense reflections: 0.1876
• Weighted residual factors for all reflections included in the refinement: 0.2338
• Goodness-of-fit parameter for all reflections included in the refinement: 1.01
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No