Information card for entry 4116756

Structure parameters

• Formula: C24 H30 I2 N6
• Calculated formula: C24 H30 I2 N6
• Title of publication: N-Methylated Diphenylguanidines: Conformations, Propeller-Type Molecular Chirality, and Construction of Water-Soluble Oligomers with Multilayered Aromatic Structures
• Authors of publication: Aya Tanatani; Kentaro Yamaguchi; Isao Azumaya; Ryuuta Fukutomi; Koichi Shudo; Hiroyuki Kagechika
• Journal of publication: Journal of the American Chemical Society
• Year of publication: 1998
• Journal volume: 120
• Pages of publication: 6433 - 6442
• a: 11.312 ± 0.002 Å
• b: 15.42 ± 0.002 Å
• c: 16.236 ± 0.003 Å
• α: 90°
• β: 101.33 ± 0.01°
• γ: 90°
• Cell volume: 2776.9 ± 0.8 ų
• Cell temperature: 296.2 K
• Ambient diffraction temperature: 296.2 K
• Number of distinct elements: 4
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/a 1
• Hall space group symbol: -P 2yab
• Residual factor for significantly intense reflections: 0.0572
• Weighted residual factors for significantly intense reflections: 0.0573
• Goodness-of-fit parameter for significantly intense reflections: 2.67
• Diffraction radiation wavelength: 1.5418 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No