Information card for entry 7153409

Structure parameters

• Formula: C28 H32 N2 O11 S3
• Calculated formula: C28 H32 N2 O11 S3
• Title of publication: The sergeants-and-soldiers effect: chiral amplification in naphthalenediimide nanotubes.
• Authors of publication: Anderson, Tom W.; Sanders, Jeremy K. M.; Pantoş, G Dan
• Journal of publication: Organic & biomolecular chemistry
• Year of publication: 2010
• Journal volume: 8
• Journal issue: 19
• Pages of publication: 4274 - 4280
• a: 9.0612 ± 0.0002 Å
• b: 11.8489 ± 0.0002 Å
• c: 28.6964 ± 0.0005 Å
• α: 90°
• β: 98.513 ± 0.001°
• γ: 90°
• Cell volume: 3047.05 ± 0.1 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 2 K
• Number of distinct elements: 5
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.0721
• Residual factor for significantly intense reflections: 0.0631
• Weighted residual factors for significantly intense reflections: 0.1676
• Weighted residual factors for all reflections included in the refinement: 0.1758
• Goodness-of-fit parameter for all reflections included in the refinement: 1.052
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No