Information card for entry 7105338

Structure parameters

• Formula: C72.25 H76.5 Cu2 N7.5 O17.75
• Calculated formula: C72.25 H62.75 Cu2 N7.5 O17.75
• Title of publication: Edge-directed [(M2)2L4] tetragonal metal-organic polyhedra decorated using a square paddle-wheel secondary building unit.
• Authors of publication: Prakash, M Jaya; Oh, Minhak; Liu, Xinfang; Han, Kwi Nam; Seong, Gi Hun; Lah, Myoung Soo
• Journal of publication: Chemical communications (Cambridge, England)
• Year of publication: 2010
• Journal volume: 46
• Journal issue: 12
• Pages of publication: 2049 - 2051
• a: 13.187 ± 0.003 Å
• b: 29.985 ± 0.006 Å
• c: 18.713 ± 0.004 Å
• α: 90°
• β: 93.93 ± 0.03°
• γ: 90°
• Cell volume: 7382 ± 3 ų
• Cell temperature: 99 ± 2 K
• Ambient diffraction temperature: 99 ± 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: 0.0829
• Residual factor for significantly intense reflections: 0.0716
• Weighted residual factors for significantly intense reflections: 0.2019
• Weighted residual factors for all reflections included in the refinement: 0.2153
• Goodness-of-fit parameter for all reflections included in the refinement: 1.025
• Diffraction radiation wavelength: 0.75 Å
• Diffraction radiation type: synchrotron
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No