Information card for entry 1100282

Structure parameters

• Formula: C31 H32 O7
• Calculated formula: C31 H32 O7
• SMILES: [C@@H]1(OC=C([C@@H]2[C@H](O[C@@H](C[C@H]12)OC)COC(c1ccccc1)(c1ccccc1)c1ccccc1)C(=O)OC)O
• Title of publication: Structure of a photolysis product
• Authors of publication: Harms, K.; Sheldrick, G. M.; Glüsenkamp, K. H.; Tietze, L. F.
• Journal of publication: Acta Crystallographica, Section C: Crystal Structure Communications
• Year of publication: 1986
• Journal volume: 42
• Journal issue: 9
• Pages of publication: 1269 - 1271
• a: 8.424 ± 0.001 Å
• b: 14.773 ± 0.002 Å
• c: 22.165 ± 0.002 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 2758.38 ų
• 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
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No