Information card for entry 4510121

Structure parameters

• Formula: C30 H37 I7 N4 O4 S2
• Calculated formula: C30 H37 I7 N4 O4 S2
• Title of publication: N-(6-Methyl-2-pyridyl)mesitylenesulfonamide: An Efficient Template for Polyiodides
• Authors of publication: Pan, Fangfang; Englert, Ulli
• Journal of publication: Crystal Growth & Design
• Year of publication: 2014
• Journal volume: 14
• Journal issue: 3
• Pages of publication: 1057
• a: 14.7755 ± 0.0019 Å
• b: 5.8535 ± 0.0007 Å
• c: 26.013 ± 0.003 Å
• α: 90°
• β: 110.101 ± 0.006°
• γ: 90°
• Cell volume: 2112.8 ± 0.5 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 6
• 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: 0.0457
• Residual factor for significantly intense reflections: 0.036
• Weighted residual factors for significantly intense reflections: 0.074
• Weighted residual factors for all reflections included in the refinement: 0.0779
• Goodness-of-fit parameter for all reflections included in the refinement: 1.129
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No