Information card for entry 2203260

Structure parameters

• Chemical name: tricaesium dihafnium pentaphosphorus octadecasulfide
• Formula: Cs3 Hf2 P5 S18
• Calculated formula: Cs3 Hf2 P5 S18
• Title of publication: Cs~3~Hf~2~(P~2~S~7~)~2~(PS~4~)
• Authors of publication: Gutzmann, Andreas; Näther, Christian; Bensch, Wolfgang
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2004
• Journal volume: 60
• Journal issue: 3
• Pages of publication: i42 - i44
• a: 9.3168 ± 0.0004 Å
• b: 9.8985 ± 0.0006 Å
• c: 34.083 ± 0.0017 Å
• α: 90°
• β: 94.236 ± 0.006°
• γ: 90°
• Cell volume: 3134.6 ± 0.3 ų
• Cell temperature: 180 ± 2 K
• Ambient diffraction temperature: 180 ± 2 K
• Number of distinct elements: 4
• Space group number: 9
• Hermann-Mauguin space group symbol: C 1 c 1
• Hall space group symbol: C -2yc
• Residual factor for all reflections: 0.0417
• Residual factor for significantly intense reflections: 0.0407
• Weighted residual factors for significantly intense reflections: 0.1033
• Weighted residual factors for all reflections included in the refinement: 0.1037
• Goodness-of-fit parameter for all reflections included in the refinement: 1.147
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes