Information card for entry 7058630

Structure parameters

• Formula: C16 H24 N O12 Zn
• Calculated formula: C16 H24 N O12 Zn
• Title of publication: Effect of counter cations on the photochromic behaviors of three Zn‒viologen complexes
• Authors of publication: Liu, Jinjian; Li, Jing; Lu, Wenbo
• Journal of publication: New Journal of Chemistry
• Year of publication: 2019
• Journal volume: 43
• Journal issue: 32
• Pages of publication: 12678
• a: 10.4847 ± 0.0003 Å
• b: 11.7732 ± 0.0003 Å
• c: 15.8026 ± 0.0004 Å
• α: 90°
• β: 92.078 ± 0.002°
• γ: 90°
• Cell volume: 1949.37 ± 0.09 ų
• Cell temperature: 273 ± 2 K
• Ambient diffraction temperature: 273 ± 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: 0.0543
• Residual factor for significantly intense reflections: 0.0429
• Weighted residual factors for significantly intense reflections: 0.1169
• Weighted residual factors for all reflections included in the refinement: 0.1272
• Goodness-of-fit parameter for all reflections included in the refinement: 1.016
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 1.54184 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No