Information card for entry 4519049

Structure parameters

• Formula: C41.5 H32.5 Co1.5 N6.5 O10
• Calculated formula: C41.5 H32.5 Co1.5 N6.5 O10
• Title of publication: Anchoring Ag(I) into Nitro-Functionalized Metal-Organic Frameworks: Effectively Catalyzing Cycloaddition of CO₂ with Propargylic Alcohols under Mild Conditions.
• Authors of publication: Zhao, Jian; Jiao, Zhuo-Hao; Hou, Sheng-Li; Ma, Yue; Zhao, Bin
• Journal of publication: ACS applied materials & interfaces
• Year of publication: 2021
• Journal volume: 13
• Journal issue: 38
• Pages of publication: 45558 - 45565
• a: 10.8396 ± 0.0005 Å
• b: 11.4532 ± 0.0006 Å
• c: 17.516 ± 0.0009 Å
• α: 99.74 ± 0.004°
• β: 97.79 ± 0.004°
• γ: 108.442 ± 0.004°
• Cell volume: 1991.16 ± 0.19 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: 0.0724
• Residual factor for significantly intense reflections: 0.0547
• Weighted residual factors for significantly intense reflections: 0.1497
• Weighted residual factors for all reflections included in the refinement: 0.1637
• Goodness-of-fit parameter for all reflections included in the refinement: 1.068
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No