Information card for entry 7129518

Structure parameters

• Formula: C121 H115 N9 O3
• Calculated formula: C121 H115 N9 O3
• Title of publication: Tweezer-type binding cavity formed by the helical folding of a carbazole–pyridine oligomer
• Authors of publication: Jang, Hye Jin; Lee, Seungwon; An, Byung Jun; Song, Geunmoo; Jeon, Hae-Geun; Jeong, Kyu-Sung
• Journal of publication: Chemical Communications
• Year of publication: 2022
• a: 22.767 ± 0.005 Å
• b: 23.169 ± 0.005 Å
• c: 20.718 ± 0.004 Å
• α: 90°
• β: 106.42 ± 0.03°
• γ: 90°
• Cell volume: 10483 ± 4 ų
• Cell temperature: 100 K
• Ambient diffraction temperature: 100 K
• Number of distinct elements: 4
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Residual factor for all reflections: 0.0866
• Residual factor for significantly intense reflections: 0.0666
• Weighted residual factors for significantly intense reflections: 0.187
• Weighted residual factors for all reflections included in the refinement: 0.1997
• Goodness-of-fit parameter for all reflections included in the refinement: 1.096
• Diffraction radiation wavelength: 0.7 Å
• Diffraction radiation type: synchrotron
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No