Information card for entry 7029732

Structure parameters

• Formula: C28 H30 Co3 N20 O4
• Calculated formula: C28 H30 Co3 N20 O4
• Title of publication: Hydrothermal synthesis, structure and magnetic properties of a three-dimensional cobalt(ii) - aminophenyltetrazolate coordination polymer.
• Authors of publication: Smith, Tiffany M; Tichenor, Michael; Zhang, Yuan-Zhu; Dunbar, Kim R; Zubieta, Jon
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2014
• Journal volume: 43
• Journal issue: 19
• Pages of publication: 7263 - 7268
• a: 6.6673 ± 0.0005 Å
• b: 21.2751 ± 0.0015 Å
• c: 13.0771 ± 0.0009 Å
• α: 90°
• β: 102.492 ± 0.002°
• γ: 90°
• Cell volume: 1811 ± 0.2 ų
• Cell temperature: 90 ± 2 K
• Ambient diffraction temperature: 90 ± 2 K
• Number of distinct elements: 5
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.0256
• Residual factor for significantly intense reflections: 0.0232
• Weighted residual factors for significantly intense reflections: 0.0543
• Weighted residual factors for all reflections included in the refinement: 0.0552
• 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