Information card for entry 7111049

Structure parameters

• Formula: C0.25 H0.25 N0.13 O0.38 W0.13
• Calculated formula: C0.245 H0.5 N0.125 O0.375 W0.125
• Title of publication: Hydrothermal synthesis and crystal structures of two novel hybrid open-frameworks and a two-dimensional network based on tungsten(vi) oxides
• Authors of publication: Yan, Bangbo; Xu, Yan; Goh, Ngoh K.; Chia, Lian S.
• Journal of publication: Chemical Communications
• Year of publication: 2000
• Journal issue: 21
• Pages of publication: 2169
• a: 5.2288 ± 0.0007 Å
• b: 5.2288 ± 0.0007 Å
• c: 14.175 ± 0.003 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 387.55 ± 0.11 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 5
• Space group number: 139
• Hermann-Mauguin space group symbol: I 4/m m m
• Hall space group symbol: -I 4 2
• Residual factor for all reflections: 0.0314
• Residual factor for significantly intense reflections: 0.0302
• Weighted residual factors for significantly intense reflections: 0.0802
• Weighted residual factors for all reflections included in the refinement: 0.0805
• Goodness-of-fit parameter for all reflections included in the refinement: 1.189
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No