Information card for entry 2204400

Structure parameters

• Chemical name: Aquanitritobis(picolinato-κ^2^N,O)cobalt(III)
• Formula: C12 H10 Co N3 O7
• Calculated formula: C12 H10 Co N3 O7
• SMILES: [Co]12([n]3ccccc3C(=O)O1)([n]1ccccc1C(=O)O2)(N(=O)=O)[OH2]
• Title of publication: Aquanitritobis(picolinato-κ^2^<i>N</i>,<i>O</i>)cobalt(III)
• Authors of publication: Chen, Bai-Quan; Han, Lei; Xu, Ying; Wu, Ben-Lai; Hong, Mao-Chun
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2004
• Journal volume: 60
• Journal issue: 10
• Pages of publication: m1376 - m1378
• a: 9.065 ± 0.002 Å
• b: 20.736 ± 0.005 Å
• c: 7.1111 ± 0.0018 Å
• α: 90°
• β: 102.166 ± 0.002°
• γ: 90°
• Cell volume: 1306.7 ± 0.5 ų
• Cell temperature: 130 ± 2 K
• Ambient diffraction temperature: 130 ± 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: 0.0313
• Residual factor for significantly intense reflections: 0.0295
• Weighted residual factors for significantly intense reflections: 0.0844
• Weighted residual factors for all reflections included in the refinement: 0.0864
• Goodness-of-fit parameter for all reflections included in the refinement: 1.035
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No