Information card for entry 7132543

Structure parameters

• Formula: C36 H28 Cl4 N4
• Calculated formula: C36 H28 Cl4 N4
• Title of publication: Self-assembly of conformation-adaptive dihydrophenazine-based coordination cages.
• Authors of publication: Wu, Meng-Xiang; Hong, Qiong-Yan; Li, Minghui; Jiang, Wei-Ling; Huang, Bin; Lu, Shuai; Wang, Heng; Yang, Hai-Bo; Zhao, Xiao-Li; Shi, Xueliang
• Journal of publication: Chemical communications (Cambridge, England)
• Year of publication: 2024
• Journal volume: 60
• Journal issue: 9
• Pages of publication: 1184 - 1187
• a: 13.1218 ± 0.0006 Å
• b: 7.9693 ± 0.0004 Å
• c: 15.0239 ± 0.0009 Å
• α: 90°
• β: 98.834 ± 0.005°
• γ: 90°
• Cell volume: 1552.44 ± 0.14 ų
• Cell temperature: 173 ± 0.1 K
• Ambient diffraction temperature: 173 ± 0.1 K
• Number of distinct elements: 4
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.0947
• Residual factor for significantly intense reflections: 0.0763
• Weighted residual factors for significantly intense reflections: 0.1969
• Weighted residual factors for all reflections included in the refinement: 0.2107
• Goodness-of-fit parameter for all reflections included in the refinement: 1.081
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 1.54184 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No