Information card for entry 7032114

Structure parameters

• Formula: C12 H12 Cu Mo4 N4 O14
• Calculated formula: C12 H10 Cu Mo4 N4 O14
• Title of publication: The coexistence of interconnected and interweaved double helices in an octamolybdate-based compound: synthesis, structure, and photocatalytic properties.
• Authors of publication: Sun, Wenlong; Zhang, Chunjing; Ma, Huiyuan; Pang, Haijun; Li, Shaobin
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2014
• Journal volume: 43
• Journal issue: 43
• Pages of publication: 16322 - 16327
• a: 13.526 ± 0.005 Å
• b: 11.743 ± 0.005 Å
• c: 13.885 ± 0.005 Å
• α: 90 ± 0.005°
• β: 107.129 ± 0.005°
• γ: 90 ± 0.005°
• Cell volume: 2107.6 ± 1.4 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 6
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.0203
• Residual factor for significantly intense reflections: 0.017
• Weighted residual factors for significantly intense reflections: 0.0414
• Weighted residual factors for all reflections included in the refinement: 0.0426
• Goodness-of-fit parameter for all reflections included in the refinement: 1.042
• Diffraction radiation wavelength: 0.71069 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No