Information card for entry 2216719

Structure parameters

• Chemical name: Di-μ-nitrato-κ^3^O,O':O'';κ^3^O:O',O''-bis[bis(3-nitrobenzohydrazide- κ^2^N',O)cadmium(II)] dinitrate
• Formula: C14 H14 Cd N8 O12
• Calculated formula: C14 H14 Cd N8 O12
• SMILES: [Cd]12([NH2]NC(=[O]1)c1cc(ccc1)N(=O)=O)(ON(=O)=O)[NH2]NC(c1cc(ccc1)N(=O)=O)=[O]2.N(=O)(=O)[O-]
• Title of publication: Di-μ-nitrato-κ^3^<i>O</i>,<i>O</i>':<i>O</i>'';κ^3^<i>O</i>:<i>O</i>',<i>O</i>''-bis[bis(3-nitrobenzohydrazide-κ^2^<i>N</i>',<i>O</i>)cadmium(II)] dinitrate
• Authors of publication: Chundak, S. Yu.; Lukachinec, L. Yu.; Daszkiewicz, M.
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2007
• Journal volume: 63
• Journal issue: 12
• Pages of publication: m2893 - m2893
• a: 7.9218 ± 0.0016 Å
• b: 7.6237 ± 0.0015 Å
• c: 34.325 ± 0.007 Å
• α: 90°
• β: 93.67 ± 0.03°
• γ: 90°
• Cell volume: 2068.8 ± 0.7 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 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: 0.086
• Residual factor for significantly intense reflections: 0.0409
• Weighted residual factors for significantly intense reflections: 0.0546
• Weighted residual factors for all reflections included in the refinement: 0.0638
• Goodness-of-fit parameter for all reflections included in the refinement: 0.935
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes