Information card for entry 2207175

Structure parameters

• Common name: Dihydroechioidinin
• Chemical name: 5,2'-Dihydroxy-7-methoxyflavanone
• Formula: C16 H14 O5
• Calculated formula: C16 H14 O5
• SMILES: O1C(CC(=O)c2c(O)cc(OC)cc12)c1c(O)cccc1
• Title of publication: 5,2'-Dihydroxy-7-methoxyflavanone
• Authors of publication: Krishnaiah, M.; Ravi Kumar, R.; Jagadeesh Kumar, N.; Gunasekar, D.; Jayaprakasam, B.
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2005
• Journal volume: 61
• Journal issue: 11
• Pages of publication: o3565 - o3567
• a: 10.1961 ± 0.001 Å
• b: 7.56 ± 0.0008 Å
• c: 18.243 ± 0.002 Å
• α: 90°
• β: 105.59 ± 0.02°
• γ: 90°
• Cell volume: 1354.5 ± 0.3 ų
• Cell temperature: 298 ± 2 K
• Ambient diffraction temperature: 298 ± 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 all reflections: 0.1501
• Residual factor for significantly intense reflections: 0.0638
• Weighted residual factors for significantly intense reflections: 0.1559
• Weighted residual factors for all reflections included in the refinement: 0.2006
• Goodness-of-fit parameter for all reflections included in the refinement: 0.963
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No