Information card for entry 7051465

Structure parameters

• Formula: C21 H26 O2 S2
• Calculated formula: C21 H26 O2 S2
• SMILES: c12CC3Cc4c(C)sc(c4CC(Cc1c(C)sc2C)C13OCCO1)C
• Authors of publication: Thiemann, Thies; Ohira, Daisuke; Li, Yuanqiang; Sawada, Tsuyoshi; Taniguchi, Masahiko; Tashiro, Masashi; Mataka, Shuntaro
• Journal of publication: New Journal of Chemistry
• Year of publication: 1999
• a: 17.52 ± 0.002 Å
• b: 11.007 ± 0.001 Å
• c: 9.9 ± 0.001 Å
• α: 90°
• β: 93.9 ± 0.01°
• γ: 90°
• Cell volume: 1904.7 ± 0.3 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 2 K
• Number of distinct elements: 4
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No