Information card for entry 7206512

Structure parameters

• Formula: C32 H37 Br4 N8 O10.5 Zn2
• Calculated formula: C32 H37 Br4 N8 O10.5 Zn2
• Title of publication: Coordination polymers and metallomacrocycles based on bis(pyridylcarbamate) ligands with flexible glycol spacers
• Authors of publication: Xia, Yana; Li, Shaoguang; Wu, Biao; Liu, Yanyan; Yang, Xiao-Juan
• Journal of publication: CrystEngComm
• Year of publication: 2011
• Journal volume: 13
• Journal issue: 19
• Pages of publication: 5763
• a: 7.8072 ± 0.0018 Å
• b: 10.931 ± 0.003 Å
• c: 13.796 ± 0.003 Å
• α: 78.771 ± 0.004°
• β: 78.627 ± 0.003°
• γ: 87.263 ± 0.004°
• Cell volume: 1132.1 ± 0.5 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0516
• Residual factor for significantly intense reflections: 0.0351
• Weighted residual factors for significantly intense reflections: 0.0847
• Weighted residual factors for all reflections included in the refinement: 0.0905
• Goodness-of-fit parameter for all reflections included in the refinement: 1.089
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No