Information card for entry 7232081

Structure parameters

• Formula: C24 H27 Cl N16 O21
• Calculated formula: C24 H27 Cl N16 O21
• Title of publication: Multicomponent crystals of nitrofurazone – when more is less
• Authors of publication: Sharara, Kudzaishe N.; Nyamayaro, Kudzanai; Wicht, Merrill M.; Venter, Gerhard A.; Báthori, Nikoletta B.
• Journal of publication: CrystEngComm
• Year of publication: 2019
• Journal volume: 21
• Journal issue: 7
• Pages of publication: 1091
• a: 7.9863 ± 0.0016 Å
• b: 14.566 ± 0.003 Å
• c: 16.208 ± 0.003 Å
• α: 77.88 ± 0.03°
• β: 80.9 ± 0.03°
• γ: 87.87 ± 0.03°
• Cell volume: 1820.2 ± 0.7 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 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: 0.0987
• Residual factor for significantly intense reflections: 0.0527
• Weighted residual factors for significantly intense reflections: 0.1198
• Weighted residual factors for all reflections included in the refinement: 0.1408
• Goodness-of-fit parameter for all reflections included in the refinement: 0.964
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No