Information card for entry 1529472

Structure parameters

• Common name: [Cd3(N4CCH2COO)2(OH)2]n
• Chemical name: [Cd3(N4CCH2COO)2(OH)2]n
• Formula: C6 H6 Cd3 N8 O6
• Calculated formula: C6 H4 Cd3 N8 O6
• Title of publication: An unprecedented organic‒inorganic hybrid material with an I3O3framework based on cadmium hydroxide and in situ generated 1H-tetrazolate-5-acetic acid
• Authors of publication: Wu, Mei-Feng; Shen, Ting-Ting; He, Shuai; Wu, Ke-Qin; Wang, Shuai-Hua; Liu, Zhi-Fa; Zheng, Fa-Kun; Guo, Guo-Cong
• Journal of publication: CrystEngComm
• Year of publication: 2015
• Journal volume: 17
• Journal issue: 39
• Pages of publication: 7473
• a: 12.808 ± 0.013 Å
• b: 24.306 ± 0.008 Å
• c: 7.7275 ± 0.0017 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 2406 ± 3 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 5
• Space group number: 43
• Hermann-Mauguin space group symbol: F d d 2
• Hall space group symbol: F 2 -2d
• Residual factor for all reflections: 0.0236
• Residual factor for significantly intense reflections: 0.0193
• Weighted residual factors for significantly intense reflections: 0.0304
• Weighted residual factors for all reflections included in the refinement: 0.0316
• Goodness-of-fit parameter for all reflections included in the refinement: 0.958
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No