Information card for entry 2001896

Structure parameters

• Formula: C17 H23 N O3 S
• Calculated formula: C17 H23 N O3 S
• SMILES: [C@@H]12CCCC[C@@H]1[C@@]1([C@H]2N(C)S(=O)(=O)c2ccc(cc2)C)OC1.[C@H]12CCCC[C@H]1[C@]1([C@@H]2N(C)S(=O)(=O)c2ccc(cc2)C)OC1
• Title of publication: 8-(<i>N</i>-Methyl-<i>N</i>-tosylamino)bicyclo[4.2.0]octane-7-spiro-2'-oxacyclopropane
• Authors of publication: Feneau-Dupont, J.; Declercq, J.-P.; Vanwetswinkel, S.; Genicot, C.
• Journal of publication: Acta Crystallographica Section C
• Year of publication: 1993
• Journal volume: 49
• Journal issue: 3
• Pages of publication: 561 - 562
• a: 8.724 ± 0.003 Å
• b: 12.009 ± 0.003 Å
• c: 15.78 ± 0.004 Å
• α: 90°
• β: 91.81 ± 0.03°
• γ: 90°
• Cell volume: 1652.4 ± 0.8 ų
• Number of distinct elements: 5
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Diffraction radiation wavelength: 0.71069 Å
• Diffraction radiation type: Mo
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No