Information card for entry 7038899

Structure parameters

• Formula: C18 H13 N3 O9 Zn
• Calculated formula: C18 H9 N3 O9 Zn
• Title of publication: Central-metal exchange, improved catalytic activity, photoluminescence properties of a new family of d(10) coordination polymers based on the 5,5'-(1H-2,3,5-triazole-1,4-diyl)diisophthalic acid ligand.
• Authors of publication: Wang, Huarui; Huang, Chao; Han, Yanbing; Shao, Zhichao; Hou, Hongwei; Fan, Yaoting
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2016
• Journal volume: 45
• Journal issue: 18
• Pages of publication: 7776 - 7785
• a: 8.0098 ± 0.0016 Å
• b: 13.813 ± 0.003 Å
• c: 22.126 ± 0.004 Å
• α: 90°
• β: 98.25 ± 0.03°
• γ: 90°
• Cell volume: 2422.7 ± 0.9 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 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: 0.1069
• Residual factor for significantly intense reflections: 0.0781
• Weighted residual factors for significantly intense reflections: 0.1888
• Weighted residual factors for all reflections included in the refinement: 0.205
• Goodness-of-fit parameter for all reflections included in the refinement: 1.078
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No