Information card for entry 4020101

Structure parameters

• Formula: C32 H26 N6
• Calculated formula: C32 H26 N6
• Authors of publication: Hidehiro Sakurai; Mendra T. S. Ritonga; Harumi Shibatani; Toshikazu Hirao
• Journal of publication: Journal of Organic Chemistry
• Year of publication: 2005
• Journal volume: 70
• Pages of publication: 2754 - 2762
• a: 6.2277 ± 0.0005 Å
• b: 19.004 ± 0.002 Å
• c: 21.034 ± 0.002 Å
• α: 90°
• β: 93.283 ± 0.002°
• γ: 90°
• Cell volume: 2485.4 ± 0.3 ų
• Cell temperature: 277.2 K
• Number of distinct elements: 3
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for significantly intense reflections: 0.0658
• Weighted residual factors for all reflections included in the refinement: 0.1941
• Goodness-of-fit parameter for all reflections included in the refinement: 0.99
• Diffraction radiation wavelength: 0.7107 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No