Information card for entry 7239453

Structure parameters

• Formula: C60 H48 Cu2 N8 O12
• Calculated formula: C60 H48 Cu2 N8 O12
• Title of publication: Five copper(ii) metal–organic coordination complexes with micro-channels based on flexible bis(imidazole) and carboxybenzaldehyde ligands; structural influence of experimental conditions on their frameworks
• Authors of publication: Wang, Hui; Safarifard, Vahid; Wang, Si-Yao; Tu, Ling-Hui; Xiao, Hong-Ping; Huang, Bi-Feng; Li, Xin-Hua; Payehghadr, Mahmood; Morsali, Ali
• Journal of publication: RSC Advances
• Year of publication: 2014
• Journal volume: 4
• Journal issue: 22
• Pages of publication: 11423
• a: 8.7519 ± 0.0005 Å
• b: 12.829 ± 0.0007 Å
• c: 13.3912 ± 0.0007 Å
• α: 77.795 ± 0.001°
• β: 89.433 ± 0.001°
• γ: 71.039 ± 0.001°
• Cell volume: 1387 ± 0.13 ų
• Cell temperature: 298 ± 2 K
• Ambient diffraction temperature: 298 ± 2 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0649
• Residual factor for significantly intense reflections: 0.0491
• Weighted residual factors for significantly intense reflections: 0.1611
• Weighted residual factors for all reflections included in the refinement: 0.1992
• Goodness-of-fit parameter for all reflections included in the refinement: 1.084
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No