Information card for entry 4313557

Structure parameters

• Chemical name: Cesium tetracyanonickelate(II) monohydrate
• Formula: C4 H2 Cs2 N4 Ni O
• Calculated formula: C4 H2 Cs2 N4 Ni O
• Title of publication: One-Dimensional Collective Electronic Effects in the Helically Stacked Cs2[Ni(CN)4].H2O and Cs2[Pt(CN)4].H2O: X-ray Structure, Polarized Specular Reflectance, and ZINDO Calculations
• Authors of publication: Jeffrey B. Cornelius; Robert M. Trapp; Terry J. Delord; Frank R. Fronczek; Steven F. Watkins; Jill Jasin Orosz; Ronald L. Musselman
• Journal of publication: Inorganic Chemistry
• Year of publication: 2003
• Journal volume: 42
• Pages of publication: 3026 - 3035
• a: 9.526 ± 0.001 Å
• b: 9.526 ± 0.001 Å
• c: 19.043 ± 0.002 Å
• α: 90°
• β: 90°
• γ: 120°
• Cell volume: 1496.5 ± 0.3 ų
• Cell temperature: 100 K
• Ambient diffraction temperature: 100 K
• Number of distinct elements: 6
• Space group number: 169
• Hermann-Mauguin space group symbol: P 61
• Hall space group symbol: P 61
• Residual factor for all reflections: 0.017
• Residual factor for significantly intense reflections: 0.016
• Weighted residual factors for significantly intense reflections: 0.034
• Weighted residual factors for all reflections included in the refinement: 0.034
• Goodness-of-fit parameter for all reflections included in the refinement: 1.119
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No