Information card for entry 7037403

Structure parameters

• Formula: C61 H52 Co2 N8 O12
• Calculated formula: C61 H52 Co2 N8 O12
• Title of publication: Hydrothermal synthesis and structural characterization of metal-organic frameworks based on new tetradentate ligands.
• Authors of publication: Liang, Yue; Yuan, Wei-Guan; Zhang, Shu-Fang; He, Zhan; Xue, Junru; Zhang, Xia; Jing, Lin-Hai; Qin, Da-Bin
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2016
• Journal volume: 45
• Journal issue: 4
• Pages of publication: 1382 - 1390
• a: 14.4417 ± 0.0003 Å
• b: 23.1157 ± 0.0008 Å
• c: 25.9453 ± 0.001 Å
• α: 114.309 ± 0.004°
• β: 100.856 ± 0.003°
• γ: 97.74 ± 0.002°
• Cell volume: 7531.1 ± 0.5 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 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: 0.1136
• Residual factor for significantly intense reflections: 0.0845
• Weighted residual factors for significantly intense reflections: 0.1746
• Weighted residual factors for all reflections included in the refinement: 0.1856
• Goodness-of-fit parameter for all reflections included in the refinement: 1.069
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No