Information card for entry 4500777

Structure parameters

• Common name: dh17
• Formula: C52 H42 O14 Zn5
• Calculated formula: C52 H42 O14 Zn5
• Title of publication: Unusual Hybrid Materials Prepared by the Oxidation of a Ketone
• Authors of publication: Holden, Daniel L.; Goulding, Helen V.; Bacsa, John; Berry, Neil G.; Greeves, Nicholas; Stephenson, Richard A.; Harrington, Ross W.; Clegg, William; Fogg, Andrew M.
• Journal of publication: Crystal Growth & Design
• Year of publication: 2011
• Journal volume: 11
• Journal issue: 7
• Pages of publication: 3013
• a: 48.786 ± 0.009 Å
• b: 5.6211 ± 0.0011 Å
• c: 16.53 ± 0.003 Å
• α: 90°
• β: 96.074 ± 0.003°
• γ: 90°
• Cell volume: 4507.6 ± 1.5 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 4
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Residual factor for all reflections: 0.0684
• Residual factor for significantly intense reflections: 0.0426
• Weighted residual factors for significantly intense reflections: 0.0969
• Weighted residual factors for all reflections included in the refinement: 0.1058
• Goodness-of-fit parameter for all reflections included in the refinement: 1.018
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No