Information card for entry 4116619

Structure parameters

• Formula: C11 H14 N O2
• Calculated formula: C11 H14 N O2
• Title of publication: Crystal-Lattice Controlled Photopolymerization of Di(benzylammonium) (Z,Z)-Muconates
• Authors of publication: Akikazu Matsumoto; Toru Odani; Masaaki Chikada; Kazuki Sada; Mikiji Miyata
• Journal of publication: Journal of the American Chemical Society
• Year of publication: 1999
• Journal volume: 121
• Pages of publication: 11122 - 11129
• a: 8.614 ± 0.002 Å
• b: 13.731 ± 0.004 Å
• c: 8.795 ± 0.003 Å
• α: 90°
• β: 103.06 ± 0.02°
• γ: 90°
• Cell volume: 1013.4 ± 0.5 ų
• Cell temperature: 296.2 K
• Ambient diffraction temperature: 296.2 K
• Number of distinct elements: 4
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/a 1
• Hall space group symbol: -P 2yab
• Residual factor for all reflections: 0.0444
• Residual factor for significantly intense reflections: 0.0444
• Weighted residual factors for significantly intense reflections: 0.1263
• Weighted residual factors for all reflections included in the refinement: 0.1263
• Goodness-of-fit parameter for all reflections included in the refinement: 1.159
• Diffraction radiation wavelength: 0.7107 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No