Information card for entry 7009385

Structure parameters

• Formula: C39 H62.33 N9 O20.67 Zn3
• Calculated formula: C39 H62.1 N9 O20.67 Zn3
• Title of publication: Synthesis and characterisation of infinite di- and tri-nuclear zinc co-ordination networks with flexible dipyridyl ligands
• Authors of publication: Plater, M. John; Foreman, Mark R. St. J.; Gelbrich, Thomas; Hursthouse, Michael B.
• Journal of publication: Journal of the Chemical Society, Dalton Transactions
• Year of publication: 2000
• Journal issue: 13
• Pages of publication: 1995
• a: 13.1599 ± 0.0004 Å
• b: 21.636 ± 0.001 Å
• c: 19.4741 ± 0.0009 Å
• α: 90°
• β: 103.855 ± 0.002°
• γ: 90°
• Cell volume: 5383.5 ± 0.4 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 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: 0.1223
• Residual factor for significantly intense reflections: 0.059
• Weighted residual factors for significantly intense reflections: 0.1323
• Weighted residual factors for all reflections included in the refinement: 0.1504
• Goodness-of-fit parameter for all reflections included in the refinement: 0.952
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No