Information card for entry 8105811

Structure parameters

• Formula: C34 H36 Co2 N8 O12
• Calculated formula: C34 H36 Co2 N8 O12
• Title of publication: Crystal structure of poly[aqua(μ2-5-methoxyisophthalato-κ2 O,O′:O′′)-(1,2-bis(imidazol-1′-yl)ethane-κ2 N:N′)cobalt(II), C34H36Co2N8O12
• Authors of publication: Ling, Xun-Li; Wei, Yue-Min; Zhang, Bi-Gang; Han, Min-Le
• Journal of publication: Zeitschrift für Kristallographie - New Crystal Structures
• Year of publication: 2019
• Journal volume: 234
• Journal issue: 4
• Pages of publication: 659 - 661
• a: 8.5834 ± 0.0008 Å
• b: 10.2975 ± 0.001 Å
• c: 22.727 ± 0.002 Å
• α: 78.325 ± 0.001°
• β: 82.934 ± 0.001°
• γ: 69.214 ± 0.001°
• Cell volume: 1836.3 ± 0.3 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296.15 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.045
• Residual factor for significantly intense reflections: 0.0319
• Weighted residual factors for significantly intense reflections: 0.0703
• Weighted residual factors for all reflections included in the refinement: 0.0761
• Goodness-of-fit parameter for all reflections included in the refinement: 1.024
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No