Information card for entry 4020378

Structure parameters

• Formula: C16 H13 F3 N2 O
• Calculated formula: C16 H13 F3 N2 O
• Title of publication: Stannous Chloride in Alcohol: A One-Pot Conversion of 2-Nitro-N-arylbenzamides to 2,3-Dihydro-1H-quinazoline-4-ones
• Authors of publication: Choong Leol Yoo; James C. Fettinger; Mark J. Kurth
• Journal of publication: Journal of Organic Chemistry
• Year of publication: 2005
• Journal volume: 70
• Pages of publication: 6941 - 6943
• a: 7.8186 ± 0.0005 Å
• b: 12.8815 ± 0.0008 Å
• c: 13.7597 ± 0.0008 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 1385.81 ± 0.15 ų
• Cell temperature: 90 ± 2 K
• Ambient diffraction temperature: 90 ± 2 K
• Number of distinct elements: 5
• Space group number: 19
• Hermann-Mauguin space group symbol: P 21 21 21
• Hall space group symbol: P 2ac 2ab
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No