Information card for entry 8100610

Structure parameters

• Formula: C24 H18 O
• Calculated formula: C24 H18 O
• SMILES: O1[C@]2([C@@H]3[C@@H](C=C3)[C@@]1(c1c2cccc1)c1ccccc1)c1ccccc1
• Title of publication: Crystal structure of (1α,8α,9β,12β)-1,8-diphenyl- 13-oxatetracyclo-[6.4.1.0^2,7^.0^9,12^]trideca-2,4,6,10-tetraene, C~24~H~18~O
• Authors of publication: Amarasekara, A. S.; Russell, R. A.; Warrener, R. N.; Tiekink, E. R. T.
• Journal of publication: Zeitschrift für Kristallographie - New Crystal Structures
• Year of publication: 2002
• Journal volume: 217
• Journal issue: 2
• Pages of publication: 213 - 214
• a: 19.87 ± 0.004 Å
• b: 16.78 ± 0.02 Å
• c: 10.52 ± 0.006 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 3507 ± 4 ų
• Cell temperature: 293 K
• Ambient diffraction temperature: 293 K
• Number of distinct elements: 3
• Space group number: 61
• Hermann-Mauguin space group symbol: P b c a
• Hall space group symbol: -P 2ac 2ab
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No