Information card for entry 7218675

Structure parameters

• Formula: C16 H20 Co N2 O7 S2
• Calculated formula: C14 H12 Co N2 O5 S
• Title of publication: Structural diversity and magnetic properties of three metal‒organic frameworks assembled from a T-shaped linker
• Authors of publication: Wang, Jing; Jing, Xuemin; Cao, Yu; Li, Guanghua; Huo, Qisheng; Liu, Yunling
• Journal of publication: CrystEngComm
• Year of publication: 2015
• Journal volume: 17
• Journal issue: 3
• Pages of publication: 604
• a: 24.755 ± 0.003 Å
• b: 24.755 ± 0.003 Å
• c: 24.755 ± 0.003 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 15170 ± 3 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 6
• Space group number: 205
• Hermann-Mauguin space group symbol: P a -3
• Hall space group symbol: -P 2ac 2ab 3
• Residual factor for all reflections: 0.135
• Residual factor for significantly intense reflections: 0.0885
• Weighted residual factors for significantly intense reflections: 0.2191
• Weighted residual factors for all reflections included in the refinement: 0.2466
• 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: Yes
• Has Fobs: No