Information card for entry 2004202

Structure parameters

• Formula: C15 H10 O3
• Calculated formula: C15 H10 O3
• SMILES: Oc1ccc2c(c1)oc(=O)c(c2)c1ccccc1
• Title of publication: 7-Hydroxy-3-phenylcoumarin, C~15~H~10~O~3~
• Authors of publication: Honda, T.; Fujii, I.; Hirayama, N.; Aoyama, N.; Miike, A.
• Journal of publication: Acta Crystallographica Section C
• Year of publication: 1995
• Journal volume: 51
• Journal issue: 12
• Pages of publication: 2712 - 2714
• a: 12.0126 ± 0.0008 Å
• b: 13.075 ± 0.002 Å
• c: 7.4562 ± 0.0008 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 1171.1 ± 0.2 ų
• Cell temperature: 293 ± 2 K
• Number of distinct elements: 3
• Space group number: 19
• Hermann-Mauguin space group symbol: P 21 21 21
• Hall space group symbol: P 2ac 2ab
• Residual factor for significantly intense reflections: 0.038
• Weighted residual factors for significantly intense reflections: 0.043
• Goodness-of-fit parameter for significantly intense reflections: 2.01
• Diffraction radiation wavelength: 1.54184 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No