Information card for entry 2243330

Structure parameters

• Common name: 4-Hydroxy-<i>N</i>-methyltryptamine
• Chemical name: 3-[2-(Methylamino)ethyl]-1<i>H</i>-indol-4-ol
• Formula: C11 H14 N2 O
• Calculated formula: C11 H14 N2 O
• Title of publication: Norpsilocin: freebase and fumarate salt
• Authors of publication: Chadeayne, Andrew R.; Pham, Duyen N. K.; Golen, James A.; Manke, David R.
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2020
• Journal volume: 76
• Journal issue: 4
• Pages of publication: 589 - 593
• a: 9.406 ± 0.0016 Å
• b: 8.8436 ± 0.0015 Å
• c: 12.144 ± 0.002 Å
• α: 90°
• β: 100.601 ± 0.007°
• γ: 90°
• Cell volume: 992.9 ± 0.3 ų
• Cell temperature: 297 ± 2 K
• Ambient diffraction temperature: 297.15 K
• Number of distinct elements: 4
• 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: 0.0448
• Residual factor for significantly intense reflections: 0.0375
• Weighted residual factors for significantly intense reflections: 0.0958
• Weighted residual factors for all reflections included in the refinement: 0.1048
• Goodness-of-fit parameter for all reflections included in the refinement: 1.086
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: Yes