Information card for entry 1529273

Structure parameters

• Formula: F7 H12 N3 Sn
• Calculated formula: F7 H12 N3 Sn
• SMILES: [Sn](F)(F)([F-])([F-])(F)F.[F-].[NH4+].[NH4+].[NH4+]
• Title of publication: Structural transformation between two cubic phases of (NH4)3SnF7
• Authors of publication: Flerov, Igor; Molokeev, Maxim; Laptash, Natalia; Udovenko, Anatoly; Pogoreltsev, Evgeniy; Melnikova, Svetlana; Misyul, Sergey
• Journal of publication: Journal of Fluorine Chemistry
• Year of publication: 2015
• Journal volume: 179
• Journal issue: 0
• Pages of publication: 86
• a: 12.0866 ± 0.0001 Å
• b: 12.0866 ± 0.0001 Å
• c: 12.0866 ± 0.0001 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 1765.68 ± 0.03 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 2 K
• Number of distinct elements: 4
• Space group number: 205
• Hermann-Mauguin space group symbol: P a -3
• Hall space group symbol: -P 2ac 2ab 3
• Residual factor for all reflections: 0.0542
• Residual factor for significantly intense reflections: 0.0254
• Weighted residual factors for significantly intense reflections: 0.0699
• Weighted residual factors for all reflections included in the refinement: 0.0881
• Goodness-of-fit parameter for all reflections included in the refinement: 1.074
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes