Information card for entry 4517670

Structure parameters

• Formula: C28 H22 N2 O8 Zn
• Calculated formula: C28 H22 N2 O8 Zn
• Title of publication: Efficient Identification for Alcohol Homologues and Hyperthermy Based on Coordination Polymer Multiple Structural Transformations.
• Authors of publication: Shao, Zhichao; Zhao, Yujie; Xie, Qiong; Wang, Hongfei; Cui, Yang; Yang, Xiaoqian; Hou, Hongwei
• Journal of publication: ACS applied materials & interfaces
• Year of publication: 2020
• Journal volume: 12
• Journal issue: 21
• Pages of publication: 24141 - 24148
• a: 7.6701 ± 0.0005 Å
• b: 11.3348 ± 0.0008 Å
• c: 15.8956 ± 0.0012 Å
• α: 76.693 ± 0.003°
• β: 84.984 ± 0.002°
• γ: 73.199 ± 0.002°
• Cell volume: 1287.11 ± 0.16 ų
• Cell temperature: 293.15 K
• Ambient diffraction temperature: 293.15 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: 0.0557
• Residual factor for significantly intense reflections: 0.0344
• Weighted residual factors for significantly intense reflections: 0.0667
• Weighted residual factors for all reflections included in the refinement: 0.0723
• Goodness-of-fit parameter for all reflections included in the refinement: 1.047
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No