Information card for entry 7241123

Structure parameters

• Formula: C28 H20 N2 O6 Zn
• Calculated formula: C28 H20 N2 O6 Zn
• Title of publication: Reversible photo/thermal solid-state transformation of a coordination polymer
• Authors of publication: Qiu, Sheng-En; Yang, Shi-Yao
• Journal of publication: CrystEngComm
• Year of publication: 2020
• a: 9.4489 ± 0.0004 Å
• b: 10.9319 ± 0.0004 Å
• c: 12.4569 ± 0.0007 Å
• α: 91.048 ± 0.005°
• β: 64.18 ± 0.004°
• γ: 85.038 ± 0.004°
• Cell volume: 1151.68 ± 0.1 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 0.1 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: 0.0617
• Residual factor for significantly intense reflections: 0.0568
• Weighted residual factors for significantly intense reflections: 0.1523
• Weighted residual factors for all reflections included in the refinement: 0.1586
• Goodness-of-fit parameter for all reflections included in the refinement: 1.006
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 1.54184 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No