Information card for entry 2204785

Structure parameters

• Chemical name: Diazidobis(2,2'-bipyridine)zinc(II) monohydrate
• Formula: C20 H18 N10 O Zn
• Calculated formula: C20 H18 N10 O Zn
• SMILES: [Zn]12([n]3ccccc3c3[n]1cccc3)([n]1ccccc1c1[n]2cccc1)(N=N#N)N=N#N.O
• Title of publication: Diazidobis(2,2'-bipyridine)zinc(II) monohydrate
• Authors of publication: Fangfang Jian; Chunlei Li; Pingping Sun; Hailian Xiao
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2004
• Journal volume: 60
• Journal issue: 12
• Pages of publication: m1811 - m1812
• a: 8.303 ± 0.0017 Å
• b: 10.334 ± 0.002 Å
• c: 13.251 ± 0.003 Å
• α: 83.74 ± 0.03°
• β: 86.98 ± 0.03°
• γ: 69.58 ± 0.03°
• Cell volume: 1059 ± 0.4 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 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: 0.0709
• Residual factor for significantly intense reflections: 0.0392
• Weighted residual factors for significantly intense reflections: 0.0749
• Weighted residual factors for all reflections included in the refinement: 0.0845
• Goodness-of-fit parameter for all reflections included in the refinement: 1.017
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes