Information card for entry 4517842

Structure parameters

• Chemical name: 1H-indole-2-methanol
• Formula: C9 H9 N O
• Calculated formula: C9 H9 N O
• 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: 8.6942 ± 0.0006 Å
• b: 5.3788 ± 0.0004 Å
• c: 31.905 ± 0.002 Å
• α: 90°
• β: 95.078 ± 0.006°
• γ: 90°
• Cell volume: 1486.16 ± 0.18 ų
• Cell temperature: 100.01 ± 0.1 K
• Ambient diffraction temperature: 100.01 ± 0.1 K
• Number of distinct elements: 4
• Space group number: 13
• Hermann-Mauguin space group symbol: P 1 2/c 1
• Hall space group symbol: -P 2yc
• Residual factor for all reflections: 0.0923
• Residual factor for significantly intense reflections: 0.0556
• Weighted residual factors for significantly intense reflections: 0.1307
• Weighted residual factors for all reflections included in the refinement: 0.1569
• Goodness-of-fit parameter for all reflections included in the refinement: 1.027
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 1.54184 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No