Information card for entry 7009642

Structure parameters

• Formula: C15 H35 N6 O11 S Zn
• Calculated formula: C15 H21 N6 O11 S Zn
• Title of publication: Networks with hexagonal circuits in co-ordination polymers of metal ions (ZnII, CdII) with 1,1'-(1,4-butanediyl)bis(imidazole)
• Authors of publication: Ma, Jian-Fang; Liu, Jing-Fu; Xing, Yan; Jia, Heng-Qing; Lin, Yong-Hua
• Journal of publication: Journal of the Chemical Society, Dalton Transactions
• Year of publication: 2000
• Journal issue: 14
• Pages of publication: 2403
• a: 12.285 ± 0.003 Å
• b: 16.375 ± 0.003 Å
• c: 12.407 ± 0.003 Å
• α: 90°
• β: 91.45 ± 0.03°
• γ: 90°
• Cell volume: 2495.1 ± 1 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 6
• 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: 0.0844
• Residual factor for significantly intense reflections: 0.0513
• Weighted residual factors for all reflections: 0.1373
• Weighted residual factors for all reflections included in the refinement: 0.1282
• Goodness-of-fit parameter for all reflections: 0.905
• Goodness-of-fit parameter for all reflections included in the refinement: 1.101
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No