Information card for entry 8105479

Structure parameters

• Chemical name: catena-poly[bis-(3,5-dinitro-1,2,4-triazolato-?^2^<i>N</i>^1^:<i>O</i>^1^)- (μ~2~-1,4-bis(1-imidazolyl)benzene-κ^2^<i>N</i>^3^:<i>N</i>^3^)copper(II)]
• Formula: C16 H10 Cu N14 O8
• Calculated formula: C16 H10 Cu N14 O8
• Title of publication: The crystal structure of catena-poly[bis-(3,5-dinitro-1,2,4-triazolato-κ2 N:O)-(μ2-1,4-bis(1-imidazolyl)benzene-κ2 N:N′)copper(II)], C16H10CuN14O8
• Authors of publication: Yajin, Li; Wuxi, Xie; Kuanguang, Song; Yu, Zhao
• Journal of publication: Zeitschrift für Kristallographie - New Crystal Structures
• Year of publication: 2020
• Journal volume: 235
• Journal issue: 6
• Pages of publication: 1407 - 1408
• a: 13.4851 ± 0.0013 Å
• b: 12.3808 ± 0.0012 Å
• c: 13.2151 ± 0.0013 Å
• α: 90°
• β: 97.304 ± 0.001°
• γ: 90°
• Cell volume: 2188.4 ± 0.4 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 2 K
• Number of distinct elements: 5
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Residual factor for all reflections: 0.036
• Residual factor for significantly intense reflections: 0.031
• Weighted residual factors for significantly intense reflections: 0.1063
• Weighted residual factors for all reflections included in the refinement: 0.1127
• Goodness-of-fit parameter for all reflections included in the refinement: 0.928
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No