Information card for entry 7033013

Structure parameters

• Formula: C8 H4 Cd N8
• Calculated formula: C8 H4 Cd N8
• Title of publication: Structural diversity of five new bitriazole-based complexes: luminescence, sorption, and magnetic properties.
• Authors of publication: Du, Li-Yun; Wang, Hui; Liu, Ge; Xie, Dong; Guo, Fu-Sheng; Hou, Lei; Wang, Yao-Yu
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2015
• Journal volume: 44
• Journal issue: 3
• Pages of publication: 1110 - 1119
• a: 9.948 ± 0.0014 Å
• b: 10.1981 ± 0.0014 Å
• c: 12.8656 ± 0.0018 Å
• α: 90°
• β: 106.089 ± 0.002°
• γ: 90°
• Cell volume: 1254.1 ± 0.3 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 2 K
• Number of distinct elements: 4
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.0436
• Residual factor for significantly intense reflections: 0.0384
• Weighted residual factors for significantly intense reflections: 0.1117
• Weighted residual factors for all reflections included in the refinement: 0.1144
• 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