Information card for entry 4319023

Structure parameters

• Formula: C6 H6 Cd0.5 N5 O
• Calculated formula: C6 H6 Cd0.5 N5 O
• Title of publication: Hydrothermal Preparation of Novel Cd(II) Coordination Polymers Employing 5-(4-Pyridyl)tetrazolate as a Bridging Ligand
• Authors of publication: Xiang Xue; Xi-Sen Wang; Li-Zhong Wang; Ren-Gen Xiong; Brendan F. Abrahams; Xiao-Zeng You; Zi-Ling Xue; Chi-Ming Che
• Journal of publication: Inorganic Chemistry
• Year of publication: 2002
• Journal volume: 41
• Pages of publication: 6544 - 6546
• a: 8.436 ± 0.0004 Å
• b: 8.0018 ± 0.0004 Å
• c: 10.8795 ± 0.0005 Å
• α: 90°
• β: 95.488 ± 0.001°
• γ: 90°
• Cell volume: 731.03 ± 0.06 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 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: 0.0418
• Residual factor for significantly intense reflections: 0.0311
• Weighted residual factors for significantly intense reflections: 0.0833
• Weighted residual factors for all reflections included in the refinement: 0.0913
• Goodness-of-fit parameter for all reflections included in the refinement: 0.609
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No