Information card for entry 4031323

Structure parameters

• Formula: C50.67 H38.67 Cl2 N2 O2
• Calculated formula: C50.6667 H38 Cl2 N2 O2
• Title of publication: Dynamic Figure Eight Chirality: Multifarious Inversions of a Helical Preference Induced by Complexation.
• Authors of publication: Katoono, Ryo; Tanaka, Yuki; Kusaka, Keiichi; Fujiwara, Kenshu; Suzuki, Takanori
• Journal of publication: The Journal of organic chemistry
• Year of publication: 2015
• Journal volume: 80
• Journal issue: 15
• Pages of publication: 7613 - 7625
• a: 32.283 ± 0.006 Å
• b: 32.283 ± 0.006 Å
• c: 21.372 ± 0.004 Å
• α: 90°
• β: 90°
• γ: 120°
• Cell volume: 19290 ± 6 ų
• Cell temperature: 150 K
• Ambient diffraction temperature: 150 K
• Number of distinct elements: 5
• Space group number: 148
• Hermann-Mauguin space group symbol: R -3 :H
• Hall space group symbol: -R 3
• Residual factor for significantly intense reflections: 0.1321
• Weighted residual factors for all reflections included in the refinement: 0.2491
• Goodness-of-fit parameter for all reflections included in the refinement: 1.595
• Diffraction radiation wavelength: 0.71075 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No