Information card for entry 7009384

Structure parameters

• Formula: C44 H57 Cl3 N6 O15 Zn2
• Calculated formula: C44 H57 Cl3 N6 O15 Zn2
• 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: 10.5216 ± 0.0006 Å
• b: 16.7671 ± 0.0009 Å
• c: 28.7044 ± 0.0016 Å
• α: 90°
• β: 89.988 ± 0.001°
• γ: 90°
• Cell volume: 5063.9 ± 0.5 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 2 K
• Number of distinct elements: 6
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.073
• Residual factor for significantly intense reflections: 0.0479
• Weighted residual factors for significantly intense reflections: 0.0999
• Weighted residual factors for all reflections included in the refinement: 0.1085
• Goodness-of-fit parameter for all reflections included in the refinement: 0.975
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No