Information card for entry 4114730

Structure parameters

• Chemical name: oktakis(μ-propionato-O,O'bis(μ-propionato-O,O)bis(μ-1,3-bis (dimethylamino)N,N'-2-propoxo-O) tetra-zinc(II)
• Formula: C32 H64 N4 O14 Zn4
• Calculated formula: C16 H32 N2 O7 Zn2
• Title of publication: Variable-Temperature Nuclear Magnetic Resonance Spectroscopy Allows Direct Observation of Carboxylate Shift in Zinc Carboxylate Complexes
• Authors of publication: Alojz Demšar; Janez Košmrlj; Saša Petriček
• Journal of publication: Journal of the American Chemical Society
• Year of publication: 2002
• Journal volume: 124
• Pages of publication: 3951 - 3958
• a: 11.647 ± 0.007 Å
• b: 10.178 ± 0.002 Å
• c: 19.63 ± 0.01 Å
• α: 90 ± 0.02°
• β: 106.97 ± 0.05°
• γ: 90 ± 0.02°
• Cell volume: 2225.7 ± 1.9 ų
• Cell temperature: 293 K
• Ambient diffraction temperature: 293 K
• Number of distinct elements: 5
• 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: 0.2
• Residual factor for significantly intense reflections: 0.042
• Weighted residual factors for all reflections: 0.268
• Weighted residual factors for significantly intense reflections: 0.047
• Goodness-of-fit parameter for all reflections: 2.998
• Goodness-of-fit parameter for significantly intense reflections: 0.95
• Diffraction radiation wavelength: 0.7107 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No