Information card for entry 4100960

Structure parameters

• Formula: C31 H28 O4
• Calculated formula: C31 H28 O4
• SMILES: Oc1c(c2c(O)c(cc3ccccc23)[C@H](OC)c2cccc(c2O)C(C)C)c2c(cc1)cccc2
• Journal of publication: Journal of the American Chemical Society
• Year of publication: 2005
• a: 9.654 ± 0.009 Å
• b: 8.269 ± 0.005 Å
• c: 15.48 ± 0.01 Å
• α: 90°
• β: 95.24 ± 0.03°
• γ: 90°
• Cell volume: 1230 ± 1 ų
• Cell temperature: 97.1 K
• Number of distinct elements: 3
• Space group number: 4
• Hermann-Mauguin space group symbol: P 1 21 1
• Hall space group symbol: P 2yb
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No