Information card for entry 7249103

Structure parameters

• Chemical name: Niclosamide dimethyl formamide solvate
• Formula: C16 H15 Cl2 N3 O5
• Calculated formula: C16 H15 Cl2 N3 O5
• Title of publication: Why does the niclosamide drug form solvates or hydrates?
• Authors of publication: Kuri, Prasitaditya; Nanubolu, Jagadeesh Babu
• Journal of publication: CrystEngComm
• Year of publication: 2024
• Journal volume: 26
• Journal issue: 32
• Pages of publication: 4313 - 4328
• a: 3.9865 ± 0.0006 Å
• b: 37.612 ± 0.005 Å
• c: 11.9718 ± 0.0015 Å
• α: 90°
• β: 95.365 ± 0.01°
• γ: 90°
• Cell volume: 1787.2 ± 0.4 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 5
• 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: 0.1259
• Residual factor for significantly intense reflections: 0.0685
• Weighted residual factors for significantly intense reflections: 0.1421
• Weighted residual factors for all reflections included in the refinement: 0.1648
• Goodness-of-fit parameter for all reflections included in the refinement: 1.041
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No