Information card for entry 1100589

Structure parameters

• Formula: C24 H32 S
• Calculated formula: C24 H32 S
• SMILES: S([C@@H]([C@H]1[C@@](CCC1)(c1ccccc1)C)C)c1c(c(cc(c1C)C)C)C.S([C@H]([C@@H]1[C@](CCC1)(c1ccccc1)C)C)c1c(c(cc(c1C)C)C)C
• Title of publication: Chiral organometallic reagents. Part XXIII. On the stereochemistry of the carbolithiation reaction of vinyl sulfides
• Authors of publication: Hoffmann, Reinhard W.; Koberstein, Ralf; Harms, Klaus
• Journal of publication: Journal of the Chemical Society, Perkin Transactions 2: Physical Organic Chemistry (1972-1999)
• Year of publication: 1999
• Journal issue: 2
• Pages of publication: 183 - 192
• a: 39.963 ± 0.004 Å
• b: 6.056 ± 0.001 Å
• c: 18.185 ± 0.002 Å
• α: 90°
• β: 112.21 ± 0.01°
• γ: 90°
• Cell volume: 4074.52 ų
• Number of distinct elements: 3
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No