Information card for entry 1564122

Structure parameters

• Formula: C25 H32 N2 O17 Zn
• Calculated formula: C25 H32 N2 O17 Zn
• Title of publication: Photochromism and hydrochromism of three complexes based on a new viologen 1-(4-carboxybutyl)-4,4′-bipyridinium ligand
• Authors of publication: Li, Jing; Liu, Jinjian; Lu, Wenbo
• Journal of publication: Inorganica Chimica Acta
• Year of publication: 2020
• Journal volume: 512
• Pages of publication: 119921
• a: 8.3553 ± 0.0004 Å
• b: 10.2916 ± 0.0006 Å
• c: 18.607 ± 0.0012 Å
• α: 84.655 ± 0.005°
• β: 87.829 ± 0.004°
• γ: 71.917 ± 0.005°
• Cell volume: 1514.3 ± 0.16 ų
• Cell temperature: 273 ± 2 K
• Ambient diffraction temperature: 273 ± 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: 0.0546
• Residual factor for significantly intense reflections: 0.0458
• Weighted residual factors for significantly intense reflections: 0.1269
• Weighted residual factors for all reflections included in the refinement: 0.1344
• Goodness-of-fit parameter for all reflections included in the refinement: 1.055
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 1.54184 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No