Information card for entry 7212481

Structure parameters

• Formula: C19 H22 N O4 Zn
• Calculated formula: C19 H22 N O4 Zn
• Title of publication: Structural diversity in a series of metal‒organic frameworks (MOFs) composed of divalent transition metals, 4,4′-bipyridine and a flexible carboxylic acid
• Authors of publication: Pachfule, Pradip; Panda, Tamas; Dey, Chandan; Banerjee, Rahul
• Journal of publication: CrystEngComm
• Year of publication: 2010
• Journal volume: 12
• Journal issue: 8
• Pages of publication: 2381
• a: 22.587 ± 0.004 Å
• b: 14.078 ± 0.003 Å
• c: 11.24 ± 0.002 Å
• α: 90°
• β: 113.424 ± 0.007°
• γ: 90°
• Cell volume: 3279.5 ± 1.1 ų
• Cell temperature: 298 ± 2 K
• Ambient diffraction temperature: 298 ± 2 K
• Number of distinct elements: 5
• 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: 0.0374
• Residual factor for significantly intense reflections: 0.0334
• Weighted residual factors for significantly intense reflections: 0.0915
• Weighted residual factors for all reflections included in the refinement: 0.0934
• Goodness-of-fit parameter for all reflections included in the refinement: 1.061
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No