Information card for entry 7213044

Structure parameters

• Formula: C2 H5 Cu Mo N O4
• Calculated formula: C2 H5 Cu Mo N O4
• Title of publication: Hydrothermal assembly and crystal structures of three novel open frameworks based on molybdenum(vi) oxides
• Authors of publication: Xu, Yan; Lu, Jianjiang; Goh, Ngoh K.
• Journal of publication: Journal of Materials Chemistry
• Year of publication: 1999
• Journal volume: 9
• Journal issue: 7
• Pages of publication: 1599
• a: 5.568 ± 0.002 Å
• b: 6.829 ± 0.002 Å
• c: 9.246 ± 0.0012 Å
• α: 100.716 ± 0.012°
• β: 101.521 ± 0.015°
• γ: 112.5 ± 0.03°
• Cell volume: 304.6 ± 0.17 ų
• Cell temperature: 297 ± 2 K
• Ambient diffraction temperature: 297 ± 2 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0324
• Residual factor for significantly intense reflections: 0.0254
• Weighted residual factors for all reflections: 0.0606
• Weighted residual factors for significantly intense reflections: 0.0532
• Goodness-of-fit parameter for all reflections: 1.067
• Goodness-of-fit parameter for significantly intense reflections: 1.089
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No