Information card for entry 4332003

Structure parameters

• Formula: C9 H22 Cd5 N36 O7
• Calculated formula: C9 H6 Cd5 N36 O3.625
• Title of publication: Two 3D Porous Cadmium Tetrazolate Frameworks with Hexagonal Tunnels
• Authors of publication: He, Xiang; Lu, Can-Zhong; Yuan, Da-Qiang
• Journal of publication: Inorganic Chemistry
• Year of publication: 2006
• Journal volume: 45
• Journal issue: 15
• Pages of publication: 5760 - 5766
• a: 26.3397 ± 0.0006 Å
• b: 26.3397 ± 0.0006 Å
• c: 13.2433 ± 0.0005 Å
• α: 90°
• β: 90°
• γ: 120°
• Cell volume: 7957 ± 0.4 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 2 K
• Number of distinct elements: 5
• Space group number: 191
• Hermann-Mauguin space group symbol: P 6/m m m
• Hall space group symbol: -P 6 2
• Residual factor for all reflections: 0.0845
• Residual factor for significantly intense reflections: 0.0842
• Weighted residual factors for significantly intense reflections: 0.2661
• Weighted residual factors for all reflections included in the refinement: 0.2663
• Goodness-of-fit parameter for all reflections included in the refinement: 1.003
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No