Information card for entry 7100206

Structure parameters

• Formula: C23 H22 O S
• Calculated formula: C23 H22 O S
• SMILES: S(=O)(c1c2CCc3ccc(CCc(c1)cc2)cc3)c1ccc(cc1)C
• Journal of publication: Chemical Communications
• Year of publication: 2005
• a: 8.1055 ± 0.0002 Å
• b: 14.4647 ± 0.0004 Å
• c: 15.233 ± 0.0005 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 1785.97 ± 0.09 ų
• Cell temperature: 173 ± 2 K
• Number of distinct elements: 4
• 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