Information card for entry 4111684

Structure parameters

• Common name: (Ph~4~As)[(C~4~H~9~N~4~)Pt(CN)~2~]^.^3.5H~2~O
• Formula: C30 H36 As N6 O3.5 Pt
• Calculated formula: C30 H36 As N6 O3.5 Pt
• Title of publication: Polymorphs with Varying Platinum(II)-Thallium(I) Interactions
• Authors of publication: Jay R. Stork; Marilyn M. Olmstead; Alan L. Balch
• Journal of publication: Journal of the American Chemical Society
• Year of publication: 2005
• Journal volume: 127
• Pages of publication: 6512 - 6513
• a: 10.7027 ± 0.0013 Å
• b: 18.094 ± 0.002 Å
• c: 16.504 ± 0.002 Å
• α: 90°
• β: 101.632 ± 0.002°
• γ: 90°
• Cell volume: 3130.4 ± 0.6 ų
• Cell temperature: 90 ± 2 K
• Ambient diffraction temperature: 90 ± 2 K
• Number of distinct elements: 6
• Space group number: 4
• Hermann-Mauguin space group symbol: P 1 21 1
• Hall space group symbol: P 2yb
• Residual factor for all reflections: 0.048
• Residual factor for significantly intense reflections: 0.0447
• Weighted residual factors for significantly intense reflections: 0.1112
• Weighted residual factors for all reflections included in the refinement: 0.113
• Goodness-of-fit parameter for all reflections included in the refinement: 1.079
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No