Information card for entry 8101179

Structure parameters

• Common name: 2-thiophenealdoxime
• Formula: C5 H5 N O S
• Calculated formula: C5 H5 N O S
• SMILES: s1c(ccc1)/C=N\O
• Title of publication: Crystal structure of 2-thiophenealdoxime, C~5~H~5~NOS
• Authors of publication: Joannou, John; Martin, Lisandra L.; Taylor, Max R.
• Journal of publication: Zeitschrift für Kristallographie - New Crystal Structures
• Year of publication: 2000
• Journal volume: 215
• Journal issue: 1
• Pages of publication: 119 - 120
• a: 11.588 ± 0.001 Å
• b: 13.724 ± 0.001 Å
• c: 7.522 ± 0.001 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 1196.3 ± 0.2 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 5
• Space group number: 29
• Hermann-Mauguin space group symbol: P c a 21
• Hall space group symbol: P 2c -2ac
• Residual factor for significantly intense reflections: 0.046
• Weighted residual factors for significantly intense reflections: 0.121
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No