Information card for entry 7233099

Structure parameters

• Chemical name: Imidazolium benzoate
• Formula: C10 H10 N2 O2
• Calculated formula: C10 H10 N2 O2
• Title of publication: Toward a new type of proton conductors based on imidazole and aromatic acids
• Authors of publication: Zięba, Sylwia; Dubis, Alina Teresa; Gzella, Andrzej K.; Ławniczak, Paweł; Pogorzelec-Glaser, Katarzyna; Lapinski, Andrzej
• Journal of publication: Physical Chemistry Chemical Physics
• Year of publication: 2019
• a: 8.7106 ± 0.0006 Å
• b: 12.3618 ± 0.0006 Å
• c: 9.2744 ± 0.0007 Å
• α: 90°
• β: 111.594 ± 0.008°
• γ: 90°
• Cell volume: 928.56 ± 0.12 ų
• Cell temperature: 130 ± 0.1 K
• Ambient diffraction temperature: 130 ± 0.1 K
• Number of distinct elements: 4
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.0489
• Residual factor for significantly intense reflections: 0.0416
• Weighted residual factors for significantly intense reflections: 0.1035
• Weighted residual factors for all reflections included in the refinement: 0.11
• Goodness-of-fit parameter for all reflections included in the refinement: 1.059
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No