Information card for entry 8101658

Structure parameters

• Formula: C16 H12 O4
• Calculated formula: C16 H12 O4
• SMILES: o1c2c(c(=O)c(c1c1ccccc1)O)cc(OC)cc2
• Title of publication: Crystal structure of 3-hydroxy-6-methoxyflavone, C~16~H~12~O~4~
• Authors of publication: Shoja, M.
• Journal of publication: Zeitschrift für Kristallographie - New Crystal Structures
• Year of publication: 1998
• Journal volume: 213
• Journal issue: 4
• Pages of publication: 731 - 732
• a: 6.745 ± 0.009 Å
• b: 9.8761 ± 0.0009 Å
• c: 19.342 ± 0.002 Å
• α: 90°
• β: 102.13 ± 0.03°
• γ: 90°
• Cell volume: 1259.7 ± 1.7 ų
• Cell temperature: 293 K
• Ambient diffraction temperature: 293 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: 0.038
• Weighted residual factors for significantly intense reflections: 0.038
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No