Information card for entry 2014688

Structure parameters

• Chemical name: Strychninium chlorate(VII) monohydrate
• Formula: C21 H25 Cl N2 O7
• Calculated formula: C21 H25 Cl N2 O7
• Title of publication: Similar environments for the ClO~4~^{-^}, HSO~4~^{-^} and H~2~PO~4~^{-^} anions offered by strychnine self-assemblies
• Authors of publication: Agata Białońska; Zbigniew Ciunik
• Journal of publication: Acta Crystallographica Section C
• Year of publication: 2005
• Journal volume: 61
• Journal issue: 3
• Pages of publication: o161 - o164
• a: 7.8016 ± 0.0008 Å
• b: 7.6538 ± 0.0009 Å
• c: 16.5597 ± 0.0017 Å
• α: 90°
• β: 93.966 ± 0.009°
• γ: 90°
• Cell volume: 986.44 ± 0.18 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 5
• Space group number: 4
• Hermann-Mauguin space group symbol: P 1 21 1
• Hall space group symbol: P 2yb
• Residual factor for all reflections: 0.0733
• Residual factor for significantly intense reflections: 0.0545
• Weighted residual factors for significantly intense reflections: 0.1318
• Weighted residual factors for all reflections included in the refinement: 0.1401
• Goodness-of-fit parameter for all reflections included in the refinement: 1.011
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: Yes