Information card for entry 2003378

Structure parameters

• Formula: C15 H17 N O4 Zn
• Calculated formula: C15 H17 N O4 Zn
• Title of publication: Contrasting Structures of Two Adducts of Zinc Crotonate with Substituted Pyridines
• Authors of publication: Clegg, W.; Hunt, P. A.; Straughan, B. P.
• Journal of publication: Acta Crystallographica Section C
• Year of publication: 1995
• Journal volume: 51
• Journal issue: 4
• Pages of publication: 613 - 617
• a: 10.343 ± 0.002 Å
• b: 18.329 ± 0.003 Å
• c: 9.671 ± 0.002 Å
• α: 90°
• β: 117.38 ± 0.02°
• γ: 90°
• Cell volume: 1628 ± 0.6 ų
• Cell temperature: 295 ± 2 K
• Ambient diffraction temperature: 295 ± 2 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: 0.0899
• Residual factor for significantly intense reflections: 0.0396
• Weighted residual factors for all reflections: 0.1129
• Weighted residual factors for significantly intense reflections: 0.0851
• Goodness-of-fit parameter for all reflections: 1.078
• Goodness-of-fit parameter for significantly intense reflections: 1.066
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: Yes