Information card for entry 7713735

Structure parameters

• Formula: C10 H20 Co2 N16 O16
• Calculated formula: C10 H20 Co2 N16 O16
• Title of publication: Energetic coordination compounds: self-assembled from the nitrogen-rich energetic C-C bonded pyrazole and triazole
• Authors of publication: Yadav, Abhishek Kumar; Rajak, Richa; Ghule, Vikas; Dharavath, Srinivas
• Journal of publication: Dalton Transactions
• Year of publication: 2023
• a: 8.822 ± 0.004 Å
• b: 9.267 ± 0.004 Å
• c: 9.384 ± 0.004 Å
• α: 94.197 ± 0.014°
• β: 108.76 ± 0.013°
• γ: 116.565 ± 0.012°
• Cell volume: 628 ± 0.5 ų
• Cell temperature: 100 K
• Ambient diffraction temperature: 100 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: 0.0754
• Residual factor for significantly intense reflections: 0.0567
• Weighted residual factors for significantly intense reflections: 0.1458
• Weighted residual factors for all reflections included in the refinement: 0.1597
• Goodness-of-fit parameter for all reflections included in the refinement: 1.047
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No