Information card for entry 2009992

Structure parameters

• Chemical name: 1-Tosyl-1H-pyrrolo[2,3-c]pyridine-5-carboxylic Acid Ethyl Ester
• Formula: C17 H16 N2 O4 S
• Calculated formula: C17 H19 N2 O4 S
• Title of publication: 1-Tosyl-1<i>H</i>-pyrrolo[2,3-<i>c</i>]pyridine-5-carboxylic acid ethyl ester
• Authors of publication: Chiaroni, Angèle; Riche, Claude; Dekhane, Mouloud; Dodd, Robert H.
• Journal of publication: Acta Crystallographica Section C
• Year of publication: 1994
• Journal volume: 50
• Journal issue: 8
• Pages of publication: 1343 - 1345
• a: 5.088 ± 0.003 Å
• b: 11.566 ± 0.008 Å
• c: 14.909 ± 0.012 Å
• α: 110.32 ± 0.03°
• β: 96.62 ± 0.03°
• γ: 91.42 ± 0.03°
• Cell volume: 815.3 ± 1 ų
• Cell temperature: 293 K
• Ambient diffraction temperature: 293 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for significantly intense reflections: 0.043
• Weighted residual factors for significantly intense reflections: 0.065
• Goodness-of-fit parameter for significantly intense reflections: 1.35
• Diffraction radiation wavelength: 1.5418 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No