Information card for entry 1560544

Structure parameters

• Formula: C45 H45 N6 O8 Zn2
• Calculated formula: C45 H45 N6 O8 Zn2
• Title of publication: Four coordination polymers based on 5- tert -butyl isophthalic acid and rigid bis(imidazol-1yl)benzene linkers: Synthesis, luminescence detection of acetone and optical properties
• Authors of publication: Arıcı, Mürsel; Zafer Yeşilel, Okan; Büyükgüngör, Orhan
• Journal of publication: Journal of Solid State Chemistry
• Year of publication: 2017
• Journal volume: 249
• Pages of publication: 141 - 148
• a: 9.8556 ± 0.0002 Å
• b: 13.2219 ± 0.0003 Å
• c: 17.8213 ± 0.0005 Å
• α: 108.644 ± 0.002°
• β: 92.555 ± 0.002°
• γ: 100.285 ± 0.002°
• Cell volume: 2152.16 ± 0.1 ų
• Cell temperature: 296 K
• Ambient diffraction temperature: 296 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: 0.039
• Residual factor for significantly intense reflections: 0.0307
• Weighted residual factors for significantly intense reflections: 0.0756
• Weighted residual factors for all reflections included in the refinement: 0.0787
• Goodness-of-fit parameter for all reflections included in the refinement: 1.016
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No