Information card for entry 1577484

Structure parameters

• Chemical name: 5-Cyclopropyl-1-[(4-methylbenzene)sulfonyl]indole-2-carbaldehyde
• Formula: C19 H17 N O3 S
• Calculated formula: C19 H17 N O3 S
• Title of publication: 5-Cyclopropyl-1-[(4-methylbenzene)sulfonyl]indole-2-carbaldehyde
• Authors of publication: Avula, Veeranjaneyulu; Keerthana V.K.,; Yash, N.D.; Umamaheshwar S.,; Govindappa, Nagendra; Muthukumaran, Jayaraman; Arumugam, Kuppuswamy; Surya Prakash Rao H.,
• Journal of publication: IUCrData
• Year of publication: 2026
• Journal volume: 11
• Journal issue: 9
• a: 9.9586 ± 0.0004 Å
• b: 21.0209 ± 0.0009 Å
• c: 7.9204 ± 0.0003 Å
• α: 90°
• β: 99.126 ± 0.002°
• γ: 90°
• Cell volume: 1637.06 ± 0.11 ų
• Cell temperature: 273 ± 2 K
• Ambient diffraction temperature: 273.15 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
• Residual factor for all reflections: 0.1035
• Residual factor for significantly intense reflections: 0.0652
• Weighted residual factors for significantly intense reflections: 0.1627
• Weighted residual factors for all reflections included in the refinement: 0.1839
• Goodness-of-fit parameter for all reflections included in the refinement: 1.062
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No