Information card for entry 7239202

Structure parameters

• Formula: C16 H19 Cd N3 O9
• Calculated formula: C16 H19 Cd N3 O9
• Title of publication: Synthesis, crystal structures and properties of transition metal coordination polymers based on a rigid triazole dicarboxylic acid
• Authors of publication: Yu, Meihui; Hu, Ming; Wu, Zhenting
• Journal of publication: RSC Advances
• Year of publication: 2013
• Journal volume: 3
• Journal issue: 47
• Pages of publication: 25175
• a: 8.5531 ± 0.0016 Å
• b: 8.5859 ± 0.0016 Å
• c: 14.526 ± 0.003 Å
• α: 74.229 ± 0.003°
• β: 86.484 ± 0.003°
• γ: 65.613 ± 0.003°
• Cell volume: 933.4 ± 0.3 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0306
• Residual factor for significantly intense reflections: 0.0265
• Weighted residual factors for significantly intense reflections: 0.0764
• Weighted residual factors for all reflections included in the refinement: 0.0881
• Goodness-of-fit parameter for all reflections included in the refinement: 1.085
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No