Information card for entry 2006712

Structure parameters

• Chemical name: Guanidinium bis[dichloromercury(II)]chloride,
• Formula: C H6 Cl5 Hg2 N3
• Calculated formula: C H6 Cl5 Hg2 N3
• SMILES: [Hg](Cl)Cl.[Hg](Cl)Cl.[Cl-].[NH2+]=C(N)N
• Title of publication: Poly{guanidinium bis[dichloromercury(II)]-μ~4~-chloro}
• Authors of publication: Kubicki, Maciej; Szafrański, Marek
• Journal of publication: Acta Crystallographica Section C
• Year of publication: 1997
• Journal volume: 53
• Journal issue: 11
• Pages of publication: 1558 - 1561
• a: 4.0367 ± 0.001 Å
• b: 14.956 ± 0.003 Å
• c: 18.404 ± 0.003 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 1111.1 ± 0.4 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 5
• Space group number: 20
• Hermann-Mauguin space group symbol: C 2 2 21
• Hall space group symbol: C 2c 2
• Residual factor for all reflections: 0.077
• Residual factor for significantly intense reflections: 0.062
• Weighted residual factors for all reflections: 0.188
• Weighted residual factors for significantly intense reflections: 0.165
• Goodness-of-fit parameter for all reflections: 1.087
• Goodness-of-fit parameter for significantly intense reflections: 1.134
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No