Information card for entry 7242087

Structure parameters

• Formula: C11 H7 Cd N7 O4
• Calculated formula: C11 H7 Cd N7 O4
• Title of publication: Synthesis, structure, and fluorescence properties of coordination polymers of 3,5-bis(1′,2′,4′-triazol-1′-yl) pyridine
• Authors of publication: Yu, Huaguang; Sun, Jing
• Journal of publication: CrystEngComm
• Year of publication: 2021
• Journal volume: 23
• Journal issue: 8
• Pages of publication: 1744 - 1755
• a: 9.7397 ± 0.0005 Å
• b: 13.5689 ± 0.0006 Å
• c: 12.187 ± 0.0006 Å
• α: 90°
• β: 113.423 ± 0.0013°
• γ: 90°
• Cell volume: 1477.88 ± 0.12 ų
• Cell temperature: 295 ± 2 K
• Ambient diffraction temperature: 295 K
• Number of distinct elements: 5
• 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: 0.027
• Residual factor for significantly intense reflections: 0.0215
• Weighted residual factors for significantly intense reflections: 0.0486
• Weighted residual factors for all reflections included in the refinement: 0.0505
• Goodness-of-fit parameter for all reflections included in the refinement: 1.033
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No