Information card for entry 7243095

Structure parameters

• Formula: C31.25 H27.25 N6.25 O8.25 Zn
• Calculated formula: C31.25 H25.25 N6.25 O8.25 Zn
• Title of publication: Bent-bis(triazolyl)-based coordination polymers tuned by dicarboxylate ligands: syntheses, structures and properties
• Authors of publication: Tseng, Tien-Wen; Luo, Tzuoo-Tsair; Tseng, Kuo-Yang; Hong, Yu-Xian; Huang, Guang-Cheng
• Journal of publication: CrystEngComm
• Year of publication: 2021
• Journal volume: 23
• Journal issue: 31
• Pages of publication: 5293 - 5305
• a: 10.2125 ± 0.0013 Å
• b: 11.4153 ± 0.0015 Å
• c: 15.21 ± 0.002 Å
• α: 95.508 ± 0.004°
• β: 102.091 ± 0.004°
• γ: 104.351 ± 0.003°
• Cell volume: 1659.1 ± 0.4 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: 0.092
• Residual factor for significantly intense reflections: 0.0643
• Weighted residual factors for significantly intense reflections: 0.1746
• Weighted residual factors for all reflections included in the refinement: 0.1989
• Goodness-of-fit parameter for all reflections included in the refinement: 1.005
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No