Information card for entry 7102394

Structure parameters

• Formula: C47 H66 Cl2 N10 O6 S2
• Calculated formula: C47 H66 Cl2 N10 O6 S2
• Title of publication: Structural codons: linearity/helicity interconversion by pyridine/pyrimidine exchange in molecular strands.
• Authors of publication: Odriozola, Ibon; Kyritsakas, Nathalie; Lehn, Jean-Marie
• Journal of publication: Chemical communications (Cambridge, England)
• Year of publication: 2004
• Journal issue: 1
• Pages of publication: 62 - 63
• a: 13.5362 ± 0.0002 Å
• b: 18.8739 ± 0.0002 Å
• c: 41.3548 ± 0.0007 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 10565.4 ± 0.3 ų
• Cell temperature: 173 K
• Ambient diffraction temperature: 173 K
• Number of distinct elements: 6
• Space group number: 61
• Hermann-Mauguin space group symbol: P b c a
• Hall space group symbol: -P 2ac 2ab
• Residual factor for all reflections: 0.201
• Residual factor for significantly intense reflections: 0.086
• Weighted residual factors for all reflections: 0.29
• Weighted residual factors for all reflections included in the refinement: 0.103
• Goodness-of-fit parameter for all reflections: 1.499
• Goodness-of-fit parameter for all reflections included in the refinement: 1.057
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: Mo-Kα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No