Information card for entry 1561520

Structure parameters

• Formula: C27 H26 N4 O9 Zn2
• Calculated formula: C27 H26 N4 O9 Zn2
• Title of publication: Positional isomerism-driven two 3D pillar-layered metal-organic frameworks: Syntheses, topological structures and photoluminescence properties
• Authors of publication: Sun, Yayong; Zhao, Siwei; Ma, Haoran; Han, Yi; Liu, Kang; Wang, Lei
• Journal of publication: Journal of Solid State Chemistry
• Year of publication: 2016
• Journal volume: 238
• Pages of publication: 284 - 290
• a: 9.106 ± 0.0005 Å
• b: 11.6972 ± 0.0005 Å
• c: 13.3469 ± 0.0007 Å
• α: 87.194 ± 0.004°
• β: 79.717 ± 0.005°
• γ: 82.506 ± 0.004°
• Cell volume: 1386.38 ± 0.12 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: 0.048
• Residual factor for significantly intense reflections: 0.0351
• Weighted residual factors for significantly intense reflections: 0.0745
• Weighted residual factors for all reflections included in the refinement: 0.0827
• Goodness-of-fit parameter for all reflections included in the refinement: 1.026
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No