Information card for entry 7246916

Structure parameters

• Formula: C10 H20 N4 O10 P3
• Calculated formula: C10 H20 N4 O10 P3
• Title of publication: Structural variety and dehydration in 3-aminopyridine–hypodiphosphoric acid–water system
• Authors of publication: Budzikur-Maciąg, Daria; Kinzhybalo, Vasyl; Ślepokura, Katarzyna
• Journal of publication: CrystEngComm
• Year of publication: 2023
• Journal volume: 25
• Journal issue: 26
• Pages of publication: 3826 - 3836
• a: 10.6024 ± 0.0014 Å
• b: 13.234 ± 0.002 Å
• c: 13.848 ± 0.002 Å
• α: 73.1 ± 0.02°
• β: 81.56 ± 0.02°
• γ: 81.96 ± 0.02°
• Cell volume: 1829.3 ± 0.5 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0911
• Residual factor for significantly intense reflections: 0.0455
• Weighted residual factors for significantly intense reflections: 0.1134
• Weighted residual factors for all reflections included in the refinement: 0.1282
• Goodness-of-fit parameter for all reflections included in the refinement: 1.063
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No