Information card for entry 2005892

Structure parameters

• Common name: Diguanidinium hexafluorate silicate
• Formula: C2 H12 F6 N6 Si
• Calculated formula: C2 H12 F6 N6 Si
• SMILES: C(=[NH2+])(N)N.F[Si](F)(F)(F)([F-])[F-].C(=[NH2+])(N)N
• Title of publication: Diguanidinium Hexafluorosilicate
• Authors of publication: Waskowska, A.
• Journal of publication: Acta Crystallographica Section C
• Year of publication: 1997
• Journal volume: 53
• Journal issue: 1
• Pages of publication: 128 - 130
• a: 12.6 ± 0.003 Å
• b: 7.258 ± 0.001 Å
• c: 6.162 ± 0.001 Å
• α: 90°
• β: 114.49 ± 0.03°
• γ: 90°
• Cell volume: 512.8 ± 0.2 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 5
• Space group number: 12
• Hermann-Mauguin space group symbol: C 1 2/m 1
• Hall space group symbol: -C 2y
• Residual factor for all reflections: 0.0389
• Residual factor for significantly intense reflections: 0.0304
• Weighted residual factors for all reflections: 0.062
• Weighted residual factors for significantly intense reflections: 0.059
• Goodness-of-fit parameter for all reflections: 1.04
• Goodness-of-fit parameter for significantly intense reflections: 1.052
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No