Information card for entry 7101470

Structure parameters

• Common name: (Zn2(polyox)(pmtz)2)
• Formula: C6 H3 N6 O2 Zn
• Calculated formula: C7 H3 N6 O3 Zn
• Title of publication: [Znn(polyox)(pmtz)n]: The first polyoxalate containing coordination polymer from an unforeseen chemical rearrangement of 5-pyrimidyl-tetrazole under hydrothermal conditions.
• Authors of publication: E Colacio; A. Rodriguez-Dieguez
• Journal of publication: Chemical Communications
• Year of publication: 2006
• Journal issue: 39
• a: 7.0292 ± 0.0008 Å
• b: 15.6245 ± 0.0017 Å
• c: 16.1876 ± 0.0017 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 1777.8 ± 0.3 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 5
• Space group number: 64
• Hermann-Mauguin space group symbol: C m c a
• Hall space group symbol: -C 2ac 2
• Residual factor for all reflections: 0.084
• Residual factor for significantly intense reflections: 0.0798
• Weighted residual factors for significantly intense reflections: 0.2239
• Weighted residual factors for all reflections included in the refinement: 0.227
• Goodness-of-fit parameter for all reflections included in the refinement: 1.225
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No