Information card for entry 7231514

Structure parameters

• Common name: ABZ-PTSAH
• Chemical name: Albendazole paratoulene sulfonic acid hydrate
• Formula: C19 H25 N3 O6 S2
• Calculated formula: C19 H25 N3 O6 S2
• Title of publication: Novel pharmaceutical salts of albendazole
• Authors of publication: Bolla, Geetha; Nangia, Ashwini
• Journal of publication: CrystEngComm
• Year of publication: 2018
• Journal volume: 20
• Journal issue: 41
• Pages of publication: 6394
• a: 8.9 ± 0.005 Å
• b: 9.573 ± 0.005 Å
• c: 14.453 ± 0.008 Å
• α: 83.026 ± 0.009°
• β: 72.434 ± 0.008°
• γ: 63.151 ± 0.008°
• Cell volume: 1047.3 ± 1 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: 0.0734
• Residual factor for significantly intense reflections: 0.0694
• Weighted residual factors for significantly intense reflections: 0.1889
• Weighted residual factors for all reflections included in the refinement: 0.1945
• Goodness-of-fit parameter for all reflections included in the refinement: 1.046
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No