Information card for entry 4517840

Structure parameters

• Chemical name: Indole
• Formula: C8 H7 N
• Calculated formula: C8 H7 N
• Title of publication: Structure and Morphology of Indole Analogue Crystals.
• Authors of publication: Pisarek, Joanna; Malinska, Maura
• Journal of publication: ACS omega
• Year of publication: 2020
• Journal volume: 5
• Journal issue: 28
• Pages of publication: 17141 - 17151
• a: 7.6102 ± 0.001 Å
• b: 5.5255 ± 0.0006 Å
• c: 14.639 ± 0.002 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 615.57 ± 0.13 ų
• Cell temperature: 100.01 ± 0.1 K
• Ambient diffraction temperature: 100.01 ± 0.1 K
• Number of distinct elements: 3
• Space group number: 33
• Hermann-Mauguin space group symbol: P n a 21
• Hall space group symbol: P 2c -2n
• Residual factor for all reflections: 0.0561
• Residual factor for significantly intense reflections: 0.0494
• Weighted residual factors for significantly intense reflections: 0.1208
• Weighted residual factors for all reflections included in the refinement: 0.1272
• Goodness-of-fit parameter for all reflections included in the refinement: 1.107
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No