Information card for entry 7060357

Structure parameters

• Formula: C36 H38 Mn2 N30 O44 Si W12
• Calculated formula: C36 H38 Mn2 N30 O44 Si W12
• Title of publication: An irregular-octagonal-prism-shaped host‒guest supramolecular network based on silicotungstate and manganese-complex for light-driven hydrogen evolution
• Authors of publication: Yang, Ruoru; Li, Bonan; Lai, Xiaoyong; Yu, Xiaojing; Xiao, Boxin; Hu, Sumin; Pang, Haijun; Ma, Huiyuan; Wang, Xinming; Tan, Lichao
• Journal of publication: New Journal of Chemistry
• Year of publication: 2021
• Journal volume: 45
• Journal issue: 8
• Pages of publication: 3954 - 3959
• a: 22.256 ± 0.005 Å
• b: 20.132 ± 0.005 Å
• c: 17.579 ± 0.005 Å
• α: 90°
• β: 107.037 ± 0.005°
• γ: 90°
• Cell volume: 7531 ± 3 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 7
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Residual factor for all reflections: 0.1082
• Residual factor for significantly intense reflections: 0.0556
• Weighted residual factors for significantly intense reflections: 0.1076
• Weighted residual factors for all reflections included in the refinement: 0.1233
• Goodness-of-fit parameter for all reflections included in the refinement: 1.095
• Diffraction radiation wavelength: 0.71069 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No