Information card for entry 4114575

Structure parameters

• Formula: C4 H12 O12 Zn2
• Calculated formula: C4 H12 O12 Zn
• Title of publication: 67Zn Solid-State and Single-Crystal NMR Spectroscopy and X-ray Crystal Structure of Zinc Formate Dihydrate
• Authors of publication: Andrew S. Lipton; Mark D. Smith; Richard D. Adams; Paul D. Ellis
• Journal of publication: Journal of the American Chemical Society
• Year of publication: 2002
• Journal volume: 124
• Pages of publication: 410 - 414
• a: 8.703 ± 0.002 Å
• b: 7.154 ± 0.002 Å
• c: 9.315 ± 0.002 Å
• α: 90°
• β: 97.63 ± 0.02°
• γ: 90°
• Cell volume: 574.8 ± 0.2 ų
• Cell temperature: 293.2 K
• Ambient diffraction temperature: 293.2 K
• Number of distinct elements: 4
• 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: 0.027
• Residual factor for significantly intense reflections: 0.027
• Weighted residual factors for all reflections: 0.0572
• Weighted residual factors for all reflections included in the refinement: 0.0572
• Goodness-of-fit parameter for all reflections: 1.264
• Goodness-of-fit parameter for all reflections included in the refinement: 1.264
• Diffraction radiation wavelength: 0.7107 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No