Information card for entry 7131102

Structure parameters

• Formula: C15 H22 N2 O3
• Calculated formula: C15 H22 N2 O3
• Title of publication: Resonant acoustic mixing (RAM) for efficient mechanoredox catalysis without grinding or impact media.
• Authors of publication: Effaty, Farshid; Gonnet, Lori; Koenig, Stefan G.; Nagapudi, Karthik; Ottenwaelder, Xavier; Friščić, Tomislav
• Journal of publication: Chemical communications (Cambridge, England)
• Year of publication: 2023
• Journal volume: 59
• Journal issue: 8
• Pages of publication: 1010 - 1013
• a: 17.1295 ± 0.0004 Å
• b: 17.2313 ± 0.0004 Å
• c: 42.1825 ± 0.0011 Å
• α: 90°
• β: 92.099 ± 0.002°
• γ: 90°
• Cell volume: 12442.4 ± 0.5 ų
• Cell temperature: 298.15 K
• Ambient diffraction temperature: 298.15 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: 0.0981
• Residual factor for significantly intense reflections: 0.0748
• Weighted residual factors for significantly intense reflections: 0.219
• Weighted residual factors for all reflections included in the refinement: 0.2434
• Goodness-of-fit parameter for all reflections included in the refinement: 1.067
• Diffraction radiation wavelength: 1.54178 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No