Information card for entry 4100445

Structure parameters

• Formula: C25 H22
• Calculated formula: C25 H22
• SMILES: [C@H]12[C@@H](c3c([C@]1(c1c(C(=C2)c2ccccc2)cccc1)C)cccc3)C.[C@@H]12[C@H](c3c([C@@]1(c1c(C(=C2)c2ccccc2)cccc1)C)cccc3)C
• Journal of publication: Journal of the American Chemical Society
• Year of publication: 2005
• a: 10.3817 ± 0.0015 Å
• b: 20.576 ± 0.003 Å
• c: 8.7912 ± 0.0013 Å
• α: 90°
• β: 101.985 ± 0.003°
• γ: 90°
• Cell volume: 1837 ± 0.5 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 2
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No