Information card for entry 8101041

Structure parameters

• Formula: C12 H17 N O3 S2
• Calculated formula: C12 H17 N O3 S2
• SMILES: S1(=O)(=NS(=O)(=O)c2ccc(C)cc2)CCCCC1
• Title of publication: Crystal structure of N1-(1-oxohexahydro-1λ^6^-thiopyran-1-yliden)- 1-benzenesulfonamide, C~12~H~17~NO~3~S~2~
• Authors of publication: Creaser, S. P.; Pyke, S. M.; Tiekink, E. R. T.
• Journal of publication: Zeitschrift für Kristallographie - New Crystal Structures
• Year of publication: 2001
• Journal volume: 216
• Journal issue: 3
• Pages of publication: 447 - 448
• a: 6.469 ± 0.004 Å
• b: 12.193 ± 0.003 Å
• c: 18.2 ± 0.004 Å
• α: 90°
• β: 98.33 ± 0.04°
• γ: 90°
• Cell volume: 1420.4 ± 0.9 ų
• Cell temperature: 293 K
• Ambient diffraction temperature: 293 K
• Number of distinct elements: 5
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No