Information card for entry 7100544

Structure parameters

• Formula: C21 H28 N6 O3
• Calculated formula: C21 H28 N6 O3
• Title of publication: Hydrogen Bond Directed Synthesis of Pyridazine and Naphthyridine Containing Macrocycles
• Authors of publication: Louis Cuccia; Todd C. Sutherland; Liyan Xing; Ulrich Ziener
• Journal of publication: Chemical Communications
• Year of publication: 2005
• a: 7.2501 ± 0.0012 Å
• b: 15.874 ± 0.003 Å
• c: 19.137 ± 0.003 Å
• α: 90°
• β: 100.558 ± 0.002°
• γ: 90°
• Cell volume: 2165.2 ± 0.6 ų
• Cell temperature: 373 ± 2 K
• Ambient diffraction temperature: 373 ± 2 K
• Number of distinct elements: 4
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No