Information card for entry 7030784

Structure parameters

• Formula: C48 H32 Co2 N24 O9 Zn5
• Calculated formula: C48 H31.98 Co2.03 N24 O8.98 Zn4.97
• Title of publication: Doping cobalt into a [Zn7] cluster-based MOF to tune magnetic behaviour and induce fluorescence signal mutation.
• Authors of publication: Li, Yun-Wu; Liu, Sui-Jun; Hu, Tong-Liang; Bu, Xian-He
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2014
• Journal volume: 43
• Journal issue: 30
• Pages of publication: 11470 - 11473
• a: 13.988 ± 0.002 Å
• b: 13.988 ± 0.002 Å
• c: 47.981 ± 0.01 Å
• α: 90°
• β: 90°
• γ: 120°
• Cell volume: 8130 ± 2 ų
• Cell temperature: 298 ± 2 K
• Ambient diffraction temperature: 298 ± 2 K
• Number of distinct elements: 6
• Space group number: 167
• Hermann-Mauguin space group symbol: R -3 c :H
• Hall space group symbol: -R 3 2"c
• Residual factor for all reflections: 0.0444
• Residual factor for significantly intense reflections: 0.0382
• Weighted residual factors for significantly intense reflections: 0.0759
• Weighted residual factors for all reflections included in the refinement: 0.0783
• Goodness-of-fit parameter for all reflections included in the refinement: 1.096
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No