Information card for entry 4514006

Structure parameters

• Formula: C40 H26 Cd N6 O4
• Calculated formula: C40 H26 Cd N6 O4
• Title of publication: Host-Guest Engineering of Coordination Polymers for Highly Tunable Luminophores Based on Charge Transfer Emissions.
• Authors of publication: Zhao, Bei; Li, Na; Wang, Xi; Chang, Ze; Bu, Xian-He
• Journal of publication: ACS applied materials & interfaces
• Year of publication: 2017
• a: 20.119 ± 0.004 Å
• b: 27.014 ± 0.005 Å
• c: 11.361 ± 0.002 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 6175 ± 2 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 2 K
• Number of distinct elements: 5
• Space group number: 62
• Hermann-Mauguin space group symbol: P n m a
• Hall space group symbol: -P 2ac 2n
• Residual factor for all reflections: 0.0528
• Residual factor for significantly intense reflections: 0.0384
• Weighted residual factors for significantly intense reflections: 0.0854
• Weighted residual factors for all reflections included in the refinement: 0.0937
• 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: No
• Has Fobs: No