Information card for entry 7208974

Structure parameters

• Formula: C60 H42 Cd6 N20 O23
• Calculated formula: C60 H42 Cd6 N20 O23
• Title of publication: Construction of diverse CdII/ZnII coordination polymers based on 5-(quinolyl)tetrazolate generated via in situ hydrothermal synthesis
• Authors of publication: Ma, Li; Yu, Naiqian; Chen, Susu; Deng, Hong
• Journal of publication: CrystEngComm
• Year of publication: 2013
• Journal volume: 15
• Journal issue: 7
• Pages of publication: 1352
• a: 8.759 ± 0.0007 Å
• b: 25.993 ± 0.002 Å
• c: 15.0096 ± 0.0011 Å
• α: 90°
• β: 103.528 ± 0.001°
• γ: 90°
• Cell volume: 3322.5 ± 0.4 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 2 K
• Number of distinct elements: 5
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Residual factor for all reflections: 0.0325
• Residual factor for significantly intense reflections: 0.0285
• Weighted residual factors for significantly intense reflections: 0.0744
• Weighted residual factors for all reflections included in the refinement: 0.0776
• Goodness-of-fit parameter for all reflections included in the refinement: 1.042
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No