Information card for entry 2204459

Structure parameters

• Chemical name: Bis(2-aminomethylpyridine-κ^2^N,N')dinitratoiron(II)
• Formula: C12 H16 Fe N6 O6
• Calculated formula: C12 H16 Fe N6 O6
• SMILES: N(=O)(=O)O[Fe]12([n]3c(cccc3)C[NH2]1)([n]1c(cccc1)C[NH2]2)ON(=O)=O
• Title of publication: Bis[2-(aminomethyl)pyridine-κ^2^<i>N</i>,<i>N</i>']dinitratoiron(II)
• Authors of publication: Chen, Guang; Yu-Xi Sun; Min Sun; Wei Qi
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2004
• Journal volume: 60
• Journal issue: 11
• Pages of publication: m1547 - m1549
• a: 8.781 ± 0.002 Å
• b: 8.845 ± 0.002 Å
• c: 10.171 ± 0.002 Å
• α: 90°
• β: 101.34 ± 0.03°
• γ: 90°
• Cell volume: 774.5 ± 0.3 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: 0.1295
• Residual factor for significantly intense reflections: 0.0774
• Weighted residual factors for significantly intense reflections: 0.1565
• Weighted residual factors for all reflections included in the refinement: 0.1792
• Goodness-of-fit parameter for all reflections included in the refinement: 0.952
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes