Information card for entry 4111402

Structure parameters

• Formula: C H K N2 O2
• Calculated formula: C H K N2 O2
• SMILES: [K+].[O-]N=CN=O
• Title of publication: Blue Alkali Dinitrosomethanides: Synthesis, Structure, and Bonding
• Authors of publication: Harald Brand; Peter Mayer; Kurt Polborn; Axel Schulz; Jan J. Weigand
• Journal of publication: Journal of the American Chemical Society
• Year of publication: 2005
• Journal volume: 127
• Pages of publication: 1360 - 1361
• a: 9.2329 ± 0.0012 Å
• b: 9.2329 ± 0.0012 Å
• c: 9.3868 ± 0.0009 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 800.19 ± 0.17 ų
• Cell temperature: 295 ± 2 K
• Ambient diffraction temperature: 295 ± 2 K
• Number of distinct elements: 5
• Space group number: 122
• Hermann-Mauguin space group symbol: I -4 2 d
• Hall space group symbol: I -4 2bw
• Residual factor for all reflections: 0.0167
• Residual factor for significantly intense reflections: 0.015
• Weighted residual factors for all reflections: 0.0351
• Weighted residual factors for significantly intense reflections: 0.0335
• Goodness-of-fit parameter for all reflections: 1.065
• Goodness-of-fit parameter for significantly intense reflections: 1.039
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No