Information card for entry 4505305

Structure parameters

• Formula: C29 H48 O7
• Calculated formula: C29 H48 O7
• Title of publication: Systematic Structural Study of Asymmetric Supramolecular Assembly by a Series of Bile Acid Derivatives with Different Side-Chain Lengths
• Authors of publication: Kato, Kazuaki; Sugahara, Michihiro; Tohnai, Norimitsu; Sada, Kazuki; Miyata, Mikiji
• Journal of publication: Crystal Growth & Design
• Year of publication: 2004
• Journal volume: 4
• Journal issue: 2
• Pages of publication: 263
• a: 12.264 ± 0.002 Å
• b: 14.452 ± 0.007 Å
• c: 8.178 ± 0.002 Å
• α: 90.48 ± 0.03°
• β: 92.88 ± 0.01°
• γ: 105.19 ± 0.02°
• Cell volume: 1396.7 ± 0.8 ų
• Cell temperature: 288.2 K
• Number of distinct elements: 3
• Space group number: 1
• Hermann-Mauguin space group symbol: P 1
• Hall space group symbol: P 1
• Residual factor for significantly intense reflections: 0.0515
• Weighted residual factors for all reflections included in the refinement: 0.1228
• Goodness-of-fit parameter for all reflections included in the refinement: 1.766
• Diffraction radiation wavelength: 0.7107 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No