Information card for entry 7121705

Structure parameters

• Formula: C74 H68 Cl2 N6 O Pd
• Calculated formula: C74 H68 Cl2 N6 O Pd
• Title of publication: Foldamer-based helicate displaying reversible switching between two distinct conformers.
• Authors of publication: Jeon, Hae-Geun; Lee, Hyun Kyung; Lee, Seungwon; Jeong, Kyu-Sung
• Journal of publication: Chemical communications (Cambridge, England)
• Year of publication: 2018
• Journal volume: 54
• Journal issue: 45
• Pages of publication: 5740 - 5743
• a: 31.021 ± 0.006 Å
• b: 22.132 ± 0.004 Å
• c: 29.199 ± 0.006 Å
• α: 90°
• β: 119.15 ± 0.03°
• γ: 90°
• Cell volume: 17508 ± 8 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 K
• Number of distinct elements: 6
• 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: 0.0835
• Residual factor for significantly intense reflections: 0.0581
• Weighted residual factors for significantly intense reflections: 0.1639
• Weighted residual factors for all reflections included in the refinement: 0.1753
• Goodness-of-fit parameter for all reflections included in the refinement: 1.034
• Diffraction radiation wavelength: 0.7 Å
• Diffraction radiation type: synchrotron
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No