Information card for entry 4516613

Structure parameters

• Formula: C51 H38 N10 O8 Zn2
• Calculated formula: C51 H38 N10 O8 Zn2
• Title of publication: Moisture-Stable Zn(II) Metal-Organic Framework as a Multifunctional Platform for Highly Efficient CO2 Capture and Nitro Pollutant Vapor Detection.
• Authors of publication: Chen, Di-Ming; Tian, Jia-Yue; Chen, Min; Liu, Chun-Sen; Du, Miao
• Journal of publication: ACS applied materials & interfaces
• Year of publication: 2016
• Journal volume: 8
• Journal issue: 28
• Pages of publication: 18043 - 18050
• a: 15.5285 ± 0.0007 Å
• b: 15.7542 ± 0.0007 Å
• c: 15.8691 ± 0.0007 Å
• α: 107.604 ± 0.004°
• β: 109.573 ± 0.004°
• γ: 109.808 ± 0.004°
• Cell volume: 3039.1 ± 0.3 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: 0.1068
• Residual factor for significantly intense reflections: 0.0833
• Weighted residual factors for significantly intense reflections: 0.2602
• Weighted residual factors for all reflections included in the refinement: 0.2846
• Goodness-of-fit parameter for all reflections included in the refinement: 1.097
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No