Information card for entry 7209081

Structure parameters

• Formula: C42.5 H44 Cd7.5 N51 O6.5
• Calculated formula: C42.5 H35 Cd7.5 N51 O6.5
• Title of publication: Azide-bridged Cd(ii) 1D coordination polymer with Cd13 nano-crown-like cluster
• Authors of publication: Bai, Shi-Qiang; Fang, Chen-Jie; He, Zheng; Gao, En-Qing; Yan, Chun-Hua; Hor, T. S. Andy
• Journal of publication: CrystEngComm
• Year of publication: 2013
• Journal volume: 15
• Journal issue: 4
• Pages of publication: 650
• a: 15.4565 ± 0.0002 Å
• b: 28.6559 ± 0.0003 Å
• c: 16.8825 ± 0.0002 Å
• α: 90°
• β: 91.2664 ± 0.0006°
• γ: 90°
• Cell volume: 7475.77 ± 0.15 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 5
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.0994
• Residual factor for significantly intense reflections: 0.037
• Weighted residual factors for significantly intense reflections: 0.0677
• Weighted residual factors for all reflections included in the refinement: 0.0773
• Goodness-of-fit parameter for all reflections included in the refinement: 0.89
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No