Information card for entry 7118897

Structure parameters

• Chemical name: BocN-(ACPC)6-(Leu)2-OBn
• Formula: C61 H95 N8 O12
• Calculated formula: C60.737 H94.856 N8 O11.783
• Title of publication: Unambiguous characterization of anisotropic foldamer packing in a foldecture with an elongated hexagonal plate shape.
• Authors of publication: Yoon, Eunyoung; Gong, Jintaek; Jung, Yoonchul; Lee, Wonchul; Driver, Russell W.; Lee, Hee-Seung
• Journal of publication: Chemical communications (Cambridge, England)
• Year of publication: 2016
• Journal volume: 52
• Journal issue: 30
• Pages of publication: 5250 - 5253
• a: 22.4 ± 0.0009 Å
• b: 29.9961 ± 0.0013 Å
• c: 9.5945 ± 0.0004 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 6446.7 ± 0.5 ų
• Cell temperature: 122 K
• Ambient diffraction temperature: 122 K
• Number of distinct elements: 4
• Space group number: 18
• Hermann-Mauguin space group symbol: P 21 21 2
• Hall space group symbol: P 2 2ab
• Residual factor for all reflections: 0.0529
• Residual factor for significantly intense reflections: 0.0508
• Weighted residual factors for all reflections: 0.1334
• Weighted residual factors for significantly intense reflections: 0.1317
• Weighted residual factors for all reflections included in the refinement: 0.1334
• Goodness-of-fit parameter for all reflections included in the refinement: 0.9351
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No