Information card for entry 7055320

Structure parameters

• Common name: AmPhOxam
• Chemical name: N-phenyloxamic acid Ammonium Salt
• Formula: C8 H10 N2 O3
• Calculated formula: C8 H10 N2 O3
• SMILES: [O-]C(=O)C(=O)Nc1ccccc1.[NH4+]
• Title of publication: Oxamate salts as novel agents for the restoration of marble and limestone substrates: case study of ammonium N-phenyloxamate
• Authors of publication: Maiore, Laura; Aragoni, Maria Carla; Carcangiu, Gianfranco; Cocco, Ombretta; Isaia, Francesco; Lippolis, Vito; Meloni, Paola; Murru, Arianna; Slawin, Alexandra; Tuveri, Enrica; Woollins, J. D.; Arca, Massimiliano
• Journal of publication: New J. Chem.
• Year of publication: 2016
• a: 18.927 ± 0.006 Å
• b: 6.364 ± 0.002 Å
• c: 7.38 ± 0.003 Å
• α: 90°
• β: 93.784 ± 0.008°
• γ: 90°
• Cell volume: 887 ± 0.5 ų
• Cell temperature: 125 K
• Ambient diffraction temperature: 125 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: 0.1578
• Residual factor for significantly intense reflections: 0.1491
• Weighted residual factors for significantly intense reflections: 0.4027
• Weighted residual factors for all reflections included in the refinement: 0.4063
• Goodness-of-fit parameter for all reflections included in the refinement: 1.26
• Diffraction radiation wavelength: 1.54187 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No