Information card for entry 2242021

Structure parameters

• Common name: Rubidium methyldiazotate
• Chemical name: Rubidium methyldiazotate
• Formula: C H3 N2 O Rb
• Calculated formula: C H3 N2 O Rb
• SMILES: [Rb+].[O-]/N=N\C
• Title of publication: Crystal structure of rubidium methyldiazotate
• Authors of publication: Grassl, Tobias; Korber, Nikolaus
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2017
• Journal volume: 73
• Journal issue: 2
• Pages of publication: 159 - 161
• a: 6.8658 ± 0.0001 Å
• b: 8.7614 ± 0.0001 Å
• c: 7.2447 ± 0.0001 Å
• α: 90°
• β: 114.219 ± 0.002°
• γ: 90°
• Cell volume: 397.441 ± 0.011 ų
• Cell temperature: 123 ± 2 K
• Ambient diffraction temperature: 123.15 K
• Number of distinct elements: 5
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.0206
• Residual factor for significantly intense reflections: 0.0173
• Weighted residual factors for significantly intense reflections: 0.0412
• Weighted residual factors for all reflections included in the refinement: 0.0416
• Goodness-of-fit parameter for all reflections included in the refinement: 1.039
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes