Information card for entry 7213043

Structure parameters

• Formula: C H Mo0.5 N0.5 O1.5
• Calculated formula: C H Mo0.5 N0.5 O1.5
• 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: 5.2702 ± 0.0015 Å
• b: 5.2674 ± 0.0007 Å
• c: 14.231 ± 0.0011 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 395.06 ± 0.13 ų
• Cell temperature: 297 ± 2 K
• Ambient diffraction temperature: 297 ± 2 K
• Number of distinct elements: 5
• Space group number: 23
• Hermann-Mauguin space group symbol: I 2 2 2
• Hall space group symbol: I 2 2
• Residual factor for all reflections: 0.0179
• Residual factor for significantly intense reflections: 0.0169
• Weighted residual factors for all reflections: 0.0433
• Weighted residual factors for significantly intense reflections: 0.0414
• Goodness-of-fit parameter for all reflections: 1.194
• Goodness-of-fit parameter for significantly intense reflections: 1.201
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No