Information card for entry 7241401

Structure parameters

• Chemical name: N, N-dimethyl-N, N-diphenylfumaramide
• Formula: C18 H18 N2 O2
• Calculated formula: C18 H18 N2 O2
• Title of publication: Crystallization-Induced Room-Temperature Phosphorescence in Fumaramides
• Authors of publication: Nitti, Andrea; Botta, Chiara; Forni, Alessandra; Cariati, Elena; Lucenti, Elena; Pasini, Dario
• Journal of publication: CrystEngComm
• Year of publication: 2020
• a: 18.21 ± 0.02 Å
• b: 7.066 ± 0.008 Å
• c: 19.77 ± 0.02 Å
• α: 90°
• β: 110.968 ± 0.01°
• γ: 90°
• Cell volume: 2375 ± 4 ų
• Cell temperature: 120 ± 2 K
• Ambient diffraction temperature: 120 ± 2 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: 0.221
• Residual factor for significantly intense reflections: 0.0898
• Weighted residual factors for significantly intense reflections: 0.2022
• Weighted residual factors for all reflections included in the refinement: 0.2795
• Goodness-of-fit parameter for all reflections included in the refinement: 0.959
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No