Information card for entry 4348258

Structure parameters

• Formula: C H14 Co N11 O7
• Calculated formula: C H14 Co N11 O7
• SMILES: c1(N(=O)=O)[n-]nnn1.[Co](N(=O)=O)(N(=O)=O)([NH3])([NH3])([NH3])[NH3].O
• Title of publication: Explosive Werner-type cobalt(iii) complexes
• Authors of publication: Deblitz, Raik; Hrib, Cristian G.; Blaurock, Steffen; Jones, Peter G.; Plenikowski, Georg; Edelmann, Frank T.
• Journal of publication: Inorg. Chem. Front.
• Year of publication: 2014
• Journal volume: 1
• Journal issue: 8
• Pages of publication: 621
• a: 7.8926 ± 0.0011 Å
• b: 7.8926 ± 0.0011 Å
• c: 19.125 ± 0.004 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 1191.4 ± 0.3 ų
• Cell temperature: 133 ± 2 K
• Ambient diffraction temperature: 133 ± 2 K
• Number of distinct elements: 5
• Space group number: 109
• Hermann-Mauguin space group symbol: I 41 m d
• Hall space group symbol: I 4bw -2
• Residual factor for all reflections: 0.0234
• Residual factor for significantly intense reflections: 0.0232
• Weighted residual factors for significantly intense reflections: 0.0565
• Weighted residual factors for all reflections included in the refinement: 0.0566
• Goodness-of-fit parameter for all reflections included in the refinement: 1.206
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No