Information card for entry 1576013

Structure parameters

• Formula: C218 H236 Cl6
• Calculated formula: C218 H236 Cl6
• Title of publication: Expanded segments of three-dimensional carbonaceous nets with chirality: synthesis and structures.
• Authors of publication: Fukunaga, Toshiya M.; Takaba, Kiyofumi; Yoshida, Satoshi; Maki-Yonekura, Saori; Yonekura, Koji; Isobe, Hiroyuki
• Journal of publication: Chemical science
• Year of publication: 2025
• Journal volume: 16
• Journal issue: 42
• Pages of publication: 19594 - 19600
• a: 19.52 ± 0.004 Å
• b: 38.42 ± 0.008 Å
• c: 35.47 ± 0.007 Å
• α: 90°
• β: 97.85 ± 0.03°
• γ: 90°
• Cell volume: 26352 ± 9 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 3
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.2438
• Residual factor for significantly intense reflections: 0.1977
• Weighted residual factors for significantly intense reflections: 0.5379
• Weighted residual factors for all reflections included in the refinement: 0.5712
• Goodness-of-fit parameter for all reflections included in the refinement: 1.561
• Diffraction radiation wavelength: 0.9 Å
• Diffraction radiation type: synchrotron
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No