Information card for entry 2104942

Structure parameters

• Formula: C12 H40 Cd3 Cl10 N4
• Calculated formula: C12 H40 Cd3 Cl10 N4
• Title of publication: Structural phase transitions in tetra(isopropylammonium) decachlorotricadmate(II), [(CH~3~)~2~CHNH~3~]~4~Cd~3~Cl~10~, crystal with a two-dimensional cadmium(II) halide network
• Authors of publication: Gagor, Anna; Waśkowska, Alicja; Czapla, Zbigniew; Dacko, Slawomir
• Journal of publication: Acta Crystallographica Section B
• Year of publication: 2011
• Journal volume: 67
• Journal issue: 2
• Pages of publication: 122 - 129
• a: 7.3918 ± 0.0002 Å
• b: 22.0135 ± 0.0007 Å
• c: 19.3938 ± 0.0005 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 3155.75 ± 0.15 ų
• Cell temperature: 275 ± 2 K
• Ambient diffraction temperature: 275 ± 2 K
• Number of distinct elements: 5
• Space group number: 19
• Hermann-Mauguin space group symbol: P 21 21 21
• Hall space group symbol: P 2ac 2ab
• Residual factor for all reflections: 0.0434
• Residual factor for significantly intense reflections: 0.0283
• Weighted residual factors for significantly intense reflections: 0.0448
• Weighted residual factors for all reflections included in the refinement: 0.0473
• Goodness-of-fit parameter for all reflections included in the refinement: 0.825
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes