Information card for entry 7021982

Structure parameters

• Formula: C64 H86 Cu2 N20 O33
• Calculated formula: C60 H64 Cu2 N20 O26
• Title of publication: Synthesis of a self-assembled copper(ii) metallo-rectangle with a guanosine-substituted terpyridine.
• Authors of publication: Ghosh, Sushobhan; Silber, Georg T.; White, Andrew J. P.; Robertson, Neil; Vilar, Ramon
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2013
• Journal volume: 42
• Journal issue: 38
• Pages of publication: 13813 - 13816
• a: 10.2878 ± 0.0003 Å
• b: 13.7254 ± 0.0005 Å
• c: 14.8599 ± 0.0005 Å
• α: 107.893 ± 0.003°
• β: 103.008 ± 0.003°
• γ: 94.397 ± 0.003°
• Cell volume: 1921.34 ± 0.12 ų
• Cell temperature: 173 K
• Ambient diffraction temperature: 173 K
• Number of distinct elements: 5
• Space group number: 1
• Hermann-Mauguin space group symbol: P 1
• Hall space group symbol: P 1
• Residual factor for all reflections: 0.0559
• Residual factor for significantly intense reflections: 0.0495
• Weighted residual factors for significantly intense reflections: 0.1327
• Weighted residual factors for all reflections included in the refinement: 0.1395
• Goodness-of-fit parameter for all reflections included in the refinement: 1.04
• Diffraction radiation wavelength: 1.54184 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No