Information card for entry 7238738

Structure parameters

• Common name: 10-methyl-5,6,11,11b-tetrahydro-1H-indolizino[8,7-b]indol-3(2H)-one
• Chemical name: 10-methyl-5,6,11,11b-tetrahydro-1H-indolizino[8,7-b]indol-3(2H)-one
• Formula: C15 H16 N2 O
• Calculated formula: C15 H16 N2 O
• Title of publication: Construction of tetrahydro-β-carboline skeletons via Brønsted acid activation of imide carbonyl group: syntheses of indole alkaloids (±)-harmicine and (±)-10-desbromoarborescidine-A
• Authors of publication: Mangalaraj, Selvaraj; Ramanathan, Chinnasamy Ramaraj
• Journal of publication: RSC Advances
• Year of publication: 2012
• Journal volume: 2
• Journal issue: 33
• Pages of publication: 12665
• a: 6.7583 ± 0.0003 Å
• b: 17.8626 ± 0.0007 Å
• c: 10.4574 ± 0.0005 Å
• α: 90°
• β: 104.431 ± 0.005°
• γ: 90°
• Cell volume: 1222.59 ± 0.1 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 4
• Space group number: 9
• Hermann-Mauguin space group symbol: C 1 c 1
• Hall space group symbol: C -2yc
• Residual factor for all reflections: 0.0529
• Residual factor for significantly intense reflections: 0.0381
• Weighted residual factors for significantly intense reflections: 0.0792
• Weighted residual factors for all reflections included in the refinement: 0.0844
• Goodness-of-fit parameter for all reflections included in the refinement: 1.003
• Diffraction radiation wavelength: 0.7107 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No