Information card for entry 1550000

Structure parameters

• Formula: Co10 Mn30 Mo96 Na24 O576 P68
• Calculated formula: Co10 Mn30 Mo96 Na24 O576 P68
• Title of publication: Hetero-metallic Active Sites Coupled with Strong Reductive Polyoxometalate for Selectively Photocatalytic CO2-to-CH4 Conversion in Water
• Authors of publication: Su, Zhong-Min; Xie, Shuai-Lei; Liu, Jiang; Dong, Long-Zhang; Li, Shun-Li; Lan, Ya-Qian
• Journal of publication: Chemical Science
• Year of publication: 2018
• a: 26.9679 ± 0.0005 Å
• b: 26.9679 ± 0.0005 Å
• c: 41.154 ± 0.0018 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 29930 ± 1.5 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 K
• Number of distinct elements: 6
• Space group number: 142
• Hermann-Mauguin space group symbol: I 41/a c d
• Hall space group symbol: -I 4bd 2c
• Residual factor for all reflections: 0.04
• Residual factor for significantly intense reflections: 0.0316
• Weighted residual factors for significantly intense reflections: 0.0736
• Weighted residual factors for all reflections included in the refinement: 0.0768
• Goodness-of-fit parameter for all reflections included in the refinement: 1.041
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No