Information card for entry 8105771

Structure parameters

• Formula: C11 H9 Co N3 O4
• Calculated formula: C11 H9 Co N3 O4
• Title of publication: Crystal structure of poly[(μ 4-(4H-1,2,4-triazol-4-yl)phenyl)acetato-κ4 N,N′,O,O′)(formiato-κ1 O)cobalt(II)], C11H9CoN3O4
• Authors of publication: Li, Xiao-Jun; Zeng, Xu-Li; Che, Li-Rui; Xu, Zhen
• Journal of publication: Zeitschrift für Kristallographie - New Crystal Structures
• Year of publication: 2019
• Journal volume: 234
• Journal issue: 3
• Pages of publication: 533 - 534
• a: 12.6503 ± 0.0009 Å
• b: 8.0959 ± 0.0006 Å
• c: 22.9723 ± 0.0014 Å
• α: 90°
• β: 99.424 ± 0.006°
• γ: 90°
• Cell volume: 2321 ± 0.3 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 5
• Space group number: 15
• Hermann-Mauguin space group symbol: I 1 2/a 1
• Hall space group symbol: -I 2ya
• Residual factor for all reflections: 0.0435
• Residual factor for significantly intense reflections: 0.037
• Weighted residual factors for significantly intense reflections: 0.0974
• Weighted residual factors for all reflections included in the refinement: 0.1101
• Goodness-of-fit parameter for all reflections included in the refinement: 1.088
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 1.54184 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No