Information card for entry 4500776

Structure parameters

• Common name: DH74
• Formula: C29 H24 O6 Zn
• Calculated formula: C29 H24 O6 Zn
• 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: 8.0336 ± 0.0011 Å
• b: 5.5785 ± 0.0007 Å
• c: 51.75 ± 0.008 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 2319.2 ± 0.6 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 4
• Space group number: 33
• Hermann-Mauguin space group symbol: P n a 21
• Hall space group symbol: P 2c -2n
• Residual factor for all reflections: 0.0746
• Residual factor for significantly intense reflections: 0.0708
• Weighted residual factors for significantly intense reflections: 0.1498
• Weighted residual factors for all reflections included in the refinement: 0.1517
• Goodness-of-fit parameter for all reflections included in the refinement: 1.153
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No