Information card for entry 2001694

Structure parameters

• Formula: C9 H16 O2 S2
• Calculated formula: C9 H16 O2 S2
• Title of publication: Structure and configuration of the Michael adduct of 2-(methylthio)thiolane <i>S</i>-oxide and butenone at 173 K
• Authors of publication: Brunck, J.-S.; Voss, J.; Olbrich, F.; Viebrock, H.
• Journal of publication: Acta Crystallographica Section C
• Year of publication: 1993
• Journal volume: 49
• Journal issue: 5
• Pages of publication: 934 - 936
• a: 7.732 ± 0.002 Å
• b: 9.533 ± 0.003 Å
• c: 14.725 ± 0.005 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 1085.4 ± 0.6 ų
• Number of distinct elements: 4
• Hermann-Mauguin space group symbol: P 21 a b
• Hall space group symbol: P -2b 2a
• Diffraction radiation wavelength: 1.54051 Å
• Diffraction radiation type: Cu
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No