Information card for entry 4502556

Structure parameters

• Common name: Cu(bpy)NbOF4.2H2O
• Formula: C10 H12 Cu F4 N2 Nb O3
• Calculated formula: C10 H12 Cu F4 N2 Nb O3
• Title of publication: Microporosity, Optical Bandgap Sizes, and Photocatalytic Activity of M(I)-Nb(V) (M = Cu, Ag) Oxyfluoride Hybrids
• Authors of publication: Lin, Haisheng; Maggard, Paul A.
• Journal of publication: Crystal Growth & Design
• Year of publication: 2010
• Journal volume: 10
• Journal issue: 3
• Pages of publication: 1323
• a: 16.5122 ± 0.0007 Å
• b: 21.6214 ± 0.0007 Å
• c: 3.8322 ± 0.0001 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 1368.16 ± 0.08 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 2 K
• Number of distinct elements: 7
• Space group number: 67
• Hermann-Mauguin space group symbol: C m m a
• Hall space group symbol: -C 2a 2
• Residual factor for all reflections: 0.0448
• Residual factor for significantly intense reflections: 0.0394
• Weighted residual factors for significantly intense reflections: 0.113
• Weighted residual factors for all reflections included in the refinement: 0.1182
• Goodness-of-fit parameter for all reflections included in the refinement: 1.125
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No