Information card for entry 7122764

Structure parameters

• Formula: C8 H6 N O8 P Zn2
• Calculated formula: C8 H6 N O8 P Zn2
• Title of publication: Carboxylic Acid-Protruding Zincophosphate Sheets Exhibiting Surface Mechanochemical Reactivity and Intriguing Nano-Morphological Reversibility
• Authors of publication: Hung, Ling-I; Yi, Hsiang-Yi; Shih, Yu-Chieh; Lin, Chia-Her; Wang, Sue-Lein
• Journal of publication: Chemical Communications
• Year of publication: 2018
• a: 16.8677 ± 0.0007 Å
• b: 6.5703 ± 0.0003 Å
• c: 9.6035 ± 0.0004 Å
• α: 90°
• β: 90.205 ± 0.002°
• γ: 90°
• Cell volume: 1064.31 ± 0.08 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 2 K
• Number of distinct elements: 6
• 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: 0.0272
• Residual factor for significantly intense reflections: 0.0205
• Weighted residual factors for significantly intense reflections: 0.0457
• Weighted residual factors for all reflections included in the refinement: 0.0475
• Goodness-of-fit parameter for all reflections included in the refinement: 1.051
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No