Information card for entry 4348256

Structure parameters

• Formula: C2 H24 Co2 N22 O8
• Calculated formula: C2 H24 Co2 N22 O8
• SMILES: c1(/N=N/c2[n-]nnn2)[n-]nnn1.[Co](N(=O)=O)([NH3])([NH3])(N(=O)=O)([NH3])[NH3].[Co](N(=O)=O)(N(=O)=O)([NH3])([NH3])([NH3])[NH3]
• 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: 7.1228 ± 0.0014 Å
• b: 7.3402 ± 0.0015 Å
• c: 10.138 ± 0.002 Å
• α: 96.49 ± 0.03°
• β: 105.79 ± 0.03°
• γ: 95.1 ± 0.03°
• Cell volume: 502.8 ± 0.2 ų
• Cell temperature: 133 ± 2 K
• Ambient diffraction temperature: 133 ± 2 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0348
• Residual factor for significantly intense reflections: 0.0325
• Weighted residual factors for significantly intense reflections: 0.086
• Weighted residual factors for all reflections included in the refinement: 0.0875
• Goodness-of-fit parameter for all reflections included in the refinement: 1.094
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No