Information card for entry 7037860

Structure parameters

• Formula: C12 H106 Mo12 N12 O79 V2
• Calculated formula: C12 H12 Mo12 O56 V2
• Title of publication: A new type of photomagnetic system: photoinduced charge transfer in polyoxometalate-based organic-inorganic hybrid.
• Authors of publication: Gao, Qiao; Li, Fengyan; Sun, Zhixia; Xu, Lin; Sun, Minghui
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2016
• Journal volume: 45
• Journal issue: 6
• Pages of publication: 2422 - 2425
• a: 19.7845 ± 0.0009 Å
• b: 28.1745 ± 0.0014 Å
• c: 30.7109 ± 0.0015 Å
• α: 90°
• β: 103.989 ± 0.001°
• γ: 90°
• Cell volume: 16611.1 ± 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: 0.0958
• Residual factor for significantly intense reflections: 0.0582
• Weighted residual factors for significantly intense reflections: 0.1626
• Weighted residual factors for all reflections included in the refinement: 0.1774
• Goodness-of-fit parameter for all reflections included in the refinement: 0.98
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No