Information card for entry 7110950

Structure parameters

• Chemical name: N,N-dibenzycarbamic acid
• Formula: C15 H15 N O2
• Calculated formula: C15 H15 N O2
• Title of publication: Isolation and structural determination of two derivatives of the elusive carbamic acid
• Authors of publication: Aresta, Michele; Ballivet-Tkatchenko, Danielle; Dell’Amico, Daniela Belli; Boschi, Daniele; Calderazzo, Fausto; Labella, Luca; Bonnet, Michel C.; Faure, René; Marchetti, Fabio
• Journal of publication: Chemical Communications
• Year of publication: 2000
• Journal issue: 13
• Pages of publication: 1099
• a: 39.397 ± 0.007 Å
• b: 5.545 ± 0.001 Å
• c: 24.783 ± 0.003 Å
• α: 90°
• β: 110.9 ± 0.01°
• γ: 90°
• Cell volume: 5057.8 ± 1.5 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 2 K
• Number of distinct elements: 4
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Residual factor for all reflections: 0.0826
• Residual factor for significantly intense reflections: 0.0411
• Weighted residual factors for significantly intense reflections: 0.0845
• Weighted residual factors for all reflections included in the refinement: 0.1012
• Goodness-of-fit parameter for all reflections included in the refinement: 1.019
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No